2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide

C22H26N2O2 — CID 1011315

IUPAC2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide
SMILESO=C(Cc1ccccc1)N[C@H]1CCCC[C@@H]1NC(=O)Cc1ccccc1
InChIInChI=1S/C22H26N2O2/c25-21(15-17-9-3-1-4-10-17)23-19-13-7-8-14-20(19)24-22(26)16-18-11-5-2-6-12-18/h1-6,9-12,19-20H,7-8,13-16H2,(H,23,25)(H,24,26)/t19-,20-/m0/s1
InChIKeyNUPJMESGDMZGQP-PMACEKPBSA-N
MW350.46 g/mol
LogP3.02
Rot. Bonds6

About 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide

2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide (PubChem CID 1011315) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide.

Molecular Properties

Compound Name2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide
PubChem CID1011315
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide
SMILESO=C(Cc1ccccc1)N[C@H]1CCCC[C@@H]1NC(=O)Cc1ccccc1
InChIInChI=1S/C22H26N2O2/c25-21(15-17-9-3-1-4-10-17)23-19-13-7-8-14-20(19)24-22(26)16-18-11-5-2-6-12-18/h1-6,9-12,19-20H,7-8,13-16H2,(H,23,25)(H,24,26)/t19-,20-/m0/s1
InChIKeyNUPJMESGDMZGQP-PMACEKPBSA-N
XLogP3.02
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876
N-cyclopropyl-2-phenylacetamide
CID 5175687
N-(2-methylcyclohexyl)-3-[(2-phenylacetyl)amino]propanamide
CID 24593173
N-(2-methylpiperidin-3-yl)-2-phenylacetamide;hydrochloride
CID 120574528
2-phenylsulfanyl-N-[(2R)-2-[(2-phenylsulfanylacetyl)amino]cyclohexyl]acetamide
CID 126728987
2-(4-methoxyphenyl)-N-[(1S,2S)-2-[[2-(4-methoxyphenyl)acetyl]amino]cyclohexyl]acetamide
CID 1012646
benzyl N-[(1R,2S)-2-[(2-chloroacetyl)amino]cyclohexyl]carbamate
CID 96552542
N-cyclopentyloxy-2-phenylacetamide
CID 83202949
N-(2-hydroxycyclohexyl)-2-(4-hydroxyphenyl)acetamide
CID 62361084
N-(cycloheptylmethyl)-2-phenylacetamide
CID 54313529
2-benzylsulfanyl-N-(2-hydroxycyclohexyl)acetamide
CID 62366139
N-[2-(cyclohexylamino)-2-oxoethyl]-2-phenylacetamide
CID 51160966

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide?
The IUPAC name of 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide (CID 1011315) is 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide.
What is the SMILES notation for 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide?
The canonical SMILES for 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide is O=C(Cc1ccccc1)N[C@H]1CCCC[C@@H]1NC(=O)Cc1ccccc1.
What is the InChIKey of 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide?
The InChIKey is NUPJMESGDMZGQP-PMACEKPBSA-N. The full InChI is InChI=1S/C22H26N2O2/c25-21(15-17-9-3-1-4-10-17)23-19-13-7-8-14-20(19)24-22(26)16-18-11-5-2-6-12-18/h1-6,9-12,19-20H,7-8,13-16H2,(H,23,25)(H,24,26)/t19-,20-/m0/s1.
What are the key properties of 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide?
2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide has a molecular weight of 350.46 g/mol, XLogP of 3.02, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[(1S,2S)-2-[(2-phenylacetyl)amino]cyclohexyl]acetamide is sourced from PubChem (CID 1011315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).