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Chemical ID: 6036893
Chemical ID:
6036893
Name [?]:
N-cyclopropyl-N-[2-(dipropylcarbamoyl)ethyl]-2-methyl-furan-3-carboxamide
SMILES [?]:
CCCN(CCC)C(=O)CCN(C1CC1)C(=O)c2ccoc2C
InChi [?]:
InChI=1/C18H28N2O3/c1-4-10-19(11-5-2)17(21)8-12-20(15-6-7-15)18(22)16-9-13-23-14(16)3/h9,13,15H,4-8,10-12H2,1-3H3
InChi Info:
AuxInfo=1/0/N:1,7,23,2,6,14,15,10,19,3,5,11,20,22,13,18,8,16,4,12,9,17,21/E:(1,2)(4,5)(6,7)(10,11)/rA:23nCCCNCCCCOCCNCCCCOCCCOCC/rB:s1;s2;s3;s4;s5;s6;s4;d8;s8;s10;s11;s12;s13;s13s14;s12;d16;s16;s18;d19;s20;d18s21;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C18H28N2O3 |
All Atoms: | 23 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.5274 |
Area: | 546.979 |
Solvation: | -3.14709 |
Coulombic: | -39.3389 |
Bond Count [?]
All: | 24 |
Single: | 20 |
Double: | 4 |
Rotors: | 11 |
Chiral: | 0 |
Rigid Segments: | 8 |
Chemical Properties
Molecular Weight: | 320.427 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 4 |
XLogP: | 1.99 |
LogP (Chemaxon): | 1.76 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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