(3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide

C21H24N2O2 — CID 675322

IUPAC(3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc2ccccc2c1)[C@@H]1CC(=O)N(C2CCCCC2)C1
InChIInChI=1S/C21H24N2O2/c24-20-13-17(14-23(20)19-8-2-1-3-9-19)21(25)22-18-11-10-15-6-4-5-7-16(15)12-18/h4-7,10-12,17,19H,1-3,8-9,13-14H2,(H,22,25)/t17-/m1/s1
InChIKeyOFVVYXLPCCISGN-QGZVFWFLSA-N
MW336.44 g/mol
LogP3.96
Rot. Bonds3

About (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide

(3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide (PubChem CID 675322) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide
PubChem CID675322
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC Name(3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc2ccccc2c1)[C@@H]1CC(=O)N(C2CCCCC2)C1
InChIInChI=1S/C21H24N2O2/c24-20-13-17(14-23(20)19-8-2-1-3-9-19)21(25)22-18-11-10-15-6-4-5-7-16(15)12-18/h4-7,10-12,17,19H,1-3,8-9,13-14H2,(H,22,25)/t17-/m1/s1
InChIKeyOFVVYXLPCCISGN-QGZVFWFLSA-N
XLogP3.96
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-cyclohexyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 2266114
1-cyclopentyl-N-[3-(cyclopropanecarbonylamino)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 46568551
1-cycloheptyl-5-oxo-N-(4-phenoxyphenyl)pyrrolidine-3-carboxamide
CID 113185562
(3R)-1-cyclopentyl-5-oxo-N-(4-phenylphenyl)pyrrolidine-3-carboxamide
CID 8571471
N-(4-acetamidophenyl)-1-cycloheptyl-5-oxopyrrolidine-3-carboxamide
CID 113185550
(3S)-N-(3-bromophenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 1116191
(3R)-1-cyclohexyl-N-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 40596002
1-cyclohexyl-N-(1H-indazol-6-yl)-5-oxopyrrolidine-3-carboxamide
CID 110678542
(3S)-1-cyclopentyl-N-(3-fluorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 9364552
1-cycloheptyl-5-oxo-N-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
CID 113185547
(3S)-N-(4-acetylphenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
CID 802193
1-cyclobutyl-N-(3,4-dichlorophenyl)-5-oxopyrrolidine-3-carboxamide
CID 110687616

Frequently Asked Questions

What is the IUPAC name of (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide (CID 675322) is (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide is O=C(Nc1ccc2ccccc2c1)[C@@H]1CC(=O)N(C2CCCCC2)C1.
What is the InChIKey of (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide?
The InChIKey is OFVVYXLPCCISGN-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H24N2O2/c24-20-13-17(14-23(20)19-8-2-1-3-9-19)21(25)22-18-11-10-15-6-4-5-7-16(15)12-18/h4-7,10-12,17,19H,1-3,8-9,13-14H2,(H,22,25)/t17-/m1/s1.
What are the key properties of (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide?
(3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 3.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-cyclohexyl-N-naphthalen-2-yl-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 675322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).