4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide

C18H25N3O2 — CID 1442013

IUPAC4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide
SMILESO=C(CNC1CCCCC1)Nc1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C18H25N3O2/c22-17(12-19-14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)18(23)21-16-10-11-16/h6-9,14,16,19H,1-5,10-12H2,(H,20,22)(H,21,23)
InChIKeyRYMYCFXFOBPKMF-UHFFFAOYSA-N
MW315.42 g/mol
LogP2.44
Rot. Bonds6

About 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide

4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide (PubChem CID 1442013) has the molecular formula C18H25N3O2 and a molecular weight of 315.42 g/mol. Its IUPAC name is 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide
PubChem CID1442013
Molecular FormulaC18H25N3O2
Molecular Weight315.42 g/mol
Exact Mass315.19
IUPAC Name4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide
SMILESO=C(CNC1CCCCC1)Nc1ccc(C(=O)NC2CC2)cc1
InChIInChI=1S/C18H25N3O2/c22-17(12-19-14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)18(23)21-16-10-11-16/h6-9,14,16,19H,1-5,10-12H2,(H,20,22)(H,21,23)
InChIKeyRYMYCFXFOBPKMF-UHFFFAOYSA-N
XLogP2.44
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 52.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclohexyl-4-(propanoylamino)benzamide
CID 977209
N,N'-bis[4-(cyclohexylcarbamoyl)phenyl]hexanediamide
CID 43878588
4-[(2-chloroacetyl)amino]-N-cyclopentylbenzamide
CID 16640624
N-(4-chlorophenyl)-2-(cyclohexylamino)acetamide
CID 788648
N-(3-bromo-4-methylphenyl)-2-(cyclohexylamino)acetamide
CID 108993617
4-acetamido-N-cyclooctylbenzamide
CID 2990044
2-(cyclopentylamino)-N-(4-hydroxyphenyl)acetamide
CID 54918004
4-[[2-(3-chloro-4-methylanilino)acetyl]amino]-N-cyclohexylbenzamide
CID 54816004
N-cyclohexyl-4-[[2-(3-methylanilino)acetyl]amino]benzamide
CID 54810258
4-[[2-(2-bromoanilino)acetyl]amino]-N-cyclohexylbenzamide
CID 54816658
4-[[2-(cyclohexylamino)acetyl]amino]-N-(oxolan-2-ylmethyl)benzamide
CID 54816576
N-cyclohexyl-4-[[2-(diethylamino)acetyl]amino]benzamide
CID 54813756

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide?
The IUPAC name of 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide (CID 1442013) is 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide.
What is the SMILES notation for 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide?
The canonical SMILES for 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide is O=C(CNC1CCCCC1)Nc1ccc(C(=O)NC2CC2)cc1.
What is the InChIKey of 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide?
The InChIKey is RYMYCFXFOBPKMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2/c22-17(12-19-14-4-2-1-3-5-14)20-15-8-6-13(7-9-15)18(23)21-16-10-11-16/h6-9,14,16,19H,1-5,10-12H2,(H,20,22)(H,21,23).
What are the key properties of 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide?
4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide has a molecular weight of 315.42 g/mol, XLogP of 2.44, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(cyclohexylamino)acetyl]amino]-N-cyclopropylbenzamide is sourced from PubChem (CID 1442013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).