2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide

C16H23N3O2 — CID 47075852

IUPAC2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide
SMILESCNC(=O)C(NC(=O)NC1CCCCC1)c1ccccc1
InChIInChI=1S/C16H23N3O2/c1-17-15(20)14(12-8-4-2-5-9-12)19-16(21)18-13-10-6-3-7-11-13/h2,4-5,8-9,13-14H,3,6-7,10-11H2,1H3,(H,17,20)(H2,18,19,21)
InChIKeyYATXBXGPIMWPTM-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.11
Rot. Bonds4

About 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide

2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide (PubChem CID 47075852) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide.

Molecular Properties

Compound Name2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide
PubChem CID47075852
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide
SMILESCNC(=O)C(NC(=O)NC1CCCCC1)c1ccccc1
InChIInChI=1S/C16H23N3O2/c1-17-15(20)14(12-8-4-2-5-9-12)19-16(21)18-13-10-6-3-7-11-13/h2,4-5,8-9,13-14H,3,6-7,10-11H2,1H3,(H,17,20)(H2,18,19,21)
InChIKeyYATXBXGPIMWPTM-UHFFFAOYSA-N
XLogP2.11
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide?
The IUPAC name of 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide (CID 47075852) is 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide.
What is the SMILES notation for 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide?
The canonical SMILES for 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide is CNC(=O)C(NC(=O)NC1CCCCC1)c1ccccc1.
What is the InChIKey of 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide?
The InChIKey is YATXBXGPIMWPTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-17-15(20)14(12-8-4-2-5-9-12)19-16(21)18-13-10-6-3-7-11-13/h2,4-5,8-9,13-14H,3,6-7,10-11H2,1H3,(H,17,20)(H2,18,19,21).
What are the key properties of 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide?
2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide has a molecular weight of 289.38 g/mol, XLogP of 2.11, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylcarbamoylamino)-N-methyl-2-phenylacetamide is sourced from PubChem (CID 47075852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).