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Chemical ID: 6032204
Chemical ID:
6032204
Name [?]:
N-cyclopropyl-N-[2-(dipropylcarbamoyl)ethyl]furan-3-carboxamide
SMILES [?]:
CCCN(CCC)C(=O)CCN(C1CC1)C(=O)c2ccoc2
InChi [?]:
InChI=1/C17H26N2O3/c1-3-9-18(10-4-2)16(20)7-11-19(15-5-6-15)17(21)14-8-12-22-13-14/h8,12-13,15H,3-7,9-11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,7,2,6,14,15,10,19,3,5,11,20,22,18,13,8,16,4,12,9,17,21/E:(1,2)(3,4)(5,6)(9,10)/rA:22nCCCNCCCCOCCNCCCCOCCCOC/rB:s1;s2;s3;s4;s5;s6;s4;d8;s8;s10;s11;s12;s13;s13s14;s12;d16;s16;s18;d19;s20;d18s21;/rC:;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H26N2O3 |
All Atoms: | 22 |
Heavy Atoms: | 22 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.0058 |
Area: | 530.173 |
Solvation: | -3.24856 |
Coulombic: | -39.1086 |
Bond Count [?]
All: | 23 |
Single: | 19 |
Double: | 4 |
Rotors: | 11 |
Chiral: | 0 |
Rigid Segments: | 8 |
Chemical Properties
Molecular Weight: | 306.4 |
H-Bond Donors: | 0 |
H-Bond Acceptors: | 4 |
XLogP: | 1.75 |
LogP (Chemaxon): | 1.74 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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