N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide

C20H20N2O — CID 121324973

IUPACN-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide
SMILESN#Cc1ccc(NC(=O)C[C@@H]2CC[C@H](c3ccccc3)C2)cc1
InChIInChI=1S/C20H20N2O/c21-14-15-7-10-19(11-8-15)22-20(23)13-16-6-9-18(12-16)17-4-2-1-3-5-17/h1-5,7-8,10-11,16,18H,6,9,12-13H2,(H,22,23)/t16-,18+/m1/s1
InChIKeyRFYFLOSXPVWOFH-AEFFLSMTSA-N
MW304.39 g/mol
LogP4.47
Rot. Bonds4

About N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide

N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide (PubChem CID 121324973) has the molecular formula C20H20N2O and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide
PubChem CID121324973
Molecular FormulaC20H20N2O
Molecular Weight304.39 g/mol
Exact Mass304.16
IUPAC NameN-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide
SMILESN#Cc1ccc(NC(=O)C[C@@H]2CC[C@H](c3ccccc3)C2)cc1
InChIInChI=1S/C20H20N2O/c21-14-15-7-10-19(11-8-15)22-20(23)13-16-6-9-18(12-16)17-4-2-1-3-5-17/h1-5,7-8,10-11,16,18H,6,9,12-13H2,(H,22,23)/t16-,18+/m1/s1
InChIKeyRFYFLOSXPVWOFH-AEFFLSMTSA-N
XLogP4.47
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-cyanophenyl)-2-cycloheptylacetamide
CID 115679897
N-(4-cyanophenyl)-2-[4-[3-(nitrosomethyl)phenyl]cyclohexyl]acetamide
CID 138502772
ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide
CID 145078209
N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide
CID 121325134
2-cyclopropyl-N-phenylacetamide
CID 60753326
(2R)-N-(4-cyanophenyl)-2-(4-phenylcyclohexyl)propanamide
CID 121325031
2-[4-(4-cyanophenyl)cyclohexyl]-N-(2,3-difluorophenyl)acetamide
CID 174865932
N-(3-cyanophenyl)-2-cyclopropylacetamide
CID 56828279
N,N'-bis(4-cyanophenyl)propanediamide
CID 108956949
N-(4-cyanophenyl)-2-[cyclopropyl(methyl)amino]acetamide
CID 43243615
2-(4-cyanophenyl)-N-phenylacetamide
CID 12672919
(2R)-N-(4-cyanophenyl)-2-(1-hydroxy-4-phenylcyclohexyl)propanamide
CID 138502801

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide?
The IUPAC name of N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide (CID 121324973) is N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide.
What is the SMILES notation for N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide?
The canonical SMILES for N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide is N#Cc1ccc(NC(=O)C[C@@H]2CC[C@H](c3ccccc3)C2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide?
The InChIKey is RFYFLOSXPVWOFH-AEFFLSMTSA-N. The full InChI is InChI=1S/C20H20N2O/c21-14-15-7-10-19(11-8-15)22-20(23)13-16-6-9-18(12-16)17-4-2-1-3-5-17/h1-5,7-8,10-11,16,18H,6,9,12-13H2,(H,22,23)/t16-,18+/m1/s1.
What are the key properties of N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide?
N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide has a molecular weight of 304.39 g/mol, XLogP of 4.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide is sourced from PubChem (CID 121324973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).