N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide

C18H25NO — CID 67394032

IUPACN-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide
SMILESO=C(N[C@H]1CCC[C@H]1c1ccccc1)C1CCCCC1
InChIInChI=1S/C18H25NO/c20-18(15-10-5-2-6-11-15)19-17-13-7-12-16(17)14-8-3-1-4-9-14/h1,3-4,8-9,15-17H,2,5-7,10-13H2,(H,19,20)/t16-,17-/m0/s1
InChIKeyHSNYKVFJZGGZOE-IRXDYDNUSA-N
MW271.40 g/mol
LogP4.02
Rot. Bonds3

About N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide

N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide (PubChem CID 67394032) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide
PubChem CID67394032
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC NameN-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide
SMILESO=C(N[C@H]1CCC[C@H]1c1ccccc1)C1CCCCC1
InChIInChI=1S/C18H25NO/c20-18(15-10-5-2-6-11-15)19-17-13-7-12-16(17)14-8-3-1-4-9-14/h1,3-4,8-9,15-17H,2,5-7,10-13H2,(H,19,20)/t16-,17-/m0/s1
InChIKeyHSNYKVFJZGGZOE-IRXDYDNUSA-N
XLogP4.02
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[(2-phenylcyclohexyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 120673133
N-(2-phenylcyclopentyl)piperidine-3-carboxamide;hydrochloride
CID 119323289
[(2S)-2-phenylcyclohexyl]urea
CID 141176309
N-(2-phenylcyclopentyl)piperidine-2-carboxamide;hydrochloride
CID 119323259
1-[(2-phenylcyclopentyl)carbamoyl]piperidine-3-carboxylic acid
CID 122001829
[(1R,2R)-2-phenylcyclopentyl]thiourea
CID 54152607
2-methyl-N-[(1R)-2-phenylcyclohexyl]propanamide
CID 170769324
2-amino-N-(2-phenylcyclopentyl)acetamide
CID 119323270
4-[(2-phenylcyclopentyl)carbamoylamino]cyclohexane-1-carboxylic acid
CID 122001828
N-[2-(cyclooctanecarbonylamino)cyclohexyl]cyclooctanecarboxamide
CID 171722262
1-amino-N-(2-phenylcyclopentyl)cyclopropane-1-carboxamide
CID 119783047
1-[[(1R,2S)-2-phenylcyclopentyl]carbamoyl]piperidine-4-carboxylic acid
CID 122012024

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide?
The IUPAC name of N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide (CID 67394032) is N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide?
The canonical SMILES for N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide is O=C(N[C@H]1CCC[C@H]1c1ccccc1)C1CCCCC1.
What is the InChIKey of N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide?
The InChIKey is HSNYKVFJZGGZOE-IRXDYDNUSA-N. The full InChI is InChI=1S/C18H25NO/c20-18(15-10-5-2-6-11-15)19-17-13-7-12-16(17)14-8-3-1-4-9-14/h1,3-4,8-9,15-17H,2,5-7,10-13H2,(H,19,20)/t16-,17-/m0/s1.
What are the key properties of N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide?
N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide has a molecular weight of 271.40 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2S)-2-phenylcyclopentyl]cyclohexanecarboxamide is sourced from PubChem (CID 67394032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).