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Chemical ID: 7278188
Chemical ID:
7278188
Name [?]:
N-cyclopentyl-3-phenyl-2-ureido-propanamide
SMILES [?]:
c1ccc(cc1)CC(C(=O)NC2CCCC2)NC(=O)N
InChi [?]:
InChI=1/C15H21N3O2/c16-15(20)18-13(10-11-6-2-1-3-7-11)14(19)17-12-8-4-5-9-12/h1-3,6-7,12-13H,4-5,8-10H2,(H,17,19)(H3,16,18,20)
InChi Info:
AuxInfo=1/1/N:1,2,6,14,15,3,5,13,16,7,4,12,8,9,18,20,11,17,10,19/E:(2,3)(4,5)(6,7)(8,9)/rA:20cCCCCCCCCCONCCCCCNCON/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;s12;s13;s14;s12s15;s8;s17;d18;s18;/rC:;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C15H21N3O2 |
All Atoms: | 41 |
Heavy Atoms: | 20 |
Chiral Atoms: | 1 |
ZAP Information [?]
Total: | 8.46521 |
Area: | 473.579 |
Solvation: | -3.37428 |
Coulombic: | -60.5377 |
Bond Count [?]
All: | 21 |
Single: | 16 |
Double: | 5 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 275.346 |
H-Bond Donors: | 4 |
H-Bond Acceptors: | 5 |
XLogP: | 1.23 |
LogP (Chemaxon): | 1.28 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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