(3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide

C21H23N3O2 — CID 97082968

IUPAC(3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2)cn1)[C@H]1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C21H23N3O2/c25-20-12-17(14-24(20)18-8-4-5-9-18)21(26)23-19-11-10-16(13-22-19)15-6-2-1-3-7-15/h1-3,6-7,10-11,13,17-18H,4-5,8-9,12,14H2,(H,22,23,26)/t17-/m0/s1
InChIKeyBYSGLDCSSWFMAP-KRWDZBQOSA-N
MW349.43 g/mol
LogP3.48
Rot. Bonds4

About (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide

(3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide (PubChem CID 97082968) has the molecular formula C21H23N3O2 and a molecular weight of 349.43 g/mol. Its IUPAC name is (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide
PubChem CID97082968
Molecular FormulaC21H23N3O2
Molecular Weight349.43 g/mol
Exact Mass349.18
IUPAC Name(3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2)cn1)[C@H]1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C21H23N3O2/c25-20-12-17(14-24(20)18-8-4-5-9-18)21(26)23-19-11-10-16(13-22-19)15-6-2-1-3-7-15/h1-3,6-7,10-11,13,17-18H,4-5,8-9,12,14H2,(H,22,23,26)/t17-/m0/s1
InChIKeyBYSGLDCSSWFMAP-KRWDZBQOSA-N
XLogP3.48
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.43
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 97082967
(3R)-1-cyclopentyl-5-oxo-N-(4-phenylphenyl)pyrrolidine-3-carboxamide
CID 8571471
(3R)-1-(cyclopropylmethyl)-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 97016454
(3S)-1-cyclopentyl-5-oxo-N-(2-phenylphenyl)pyrrolidine-3-carboxamide
CID 51630288
(3S)-1-cyclohexyl-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 2266114
1-cyclopentyl-N-[3-(cyclopropanecarbonylamino)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 46568551
(3R)-1-cyclohexyl-N-(2-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 40822798
1-cycloheptyl-5-oxo-N-(4-phenoxyphenyl)pyrrolidine-3-carboxamide
CID 113185562
1-cyano-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide
CID 118980507
1-cyclopentyl-N-(4-methoxy-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 146123420
(3R)-1-cyclohexyl-N-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 40596002
N-(1-benzylpyrazol-4-yl)-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide
CID 55983153

Frequently Asked Questions

What is the IUPAC name of (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide?
The IUPAC name of (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide (CID 97082968) is (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide?
The canonical SMILES for (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide is O=C(Nc1ccc(-c2ccccc2)cn1)[C@H]1CC(=O)N(C2CCCC2)C1.
What is the InChIKey of (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide?
The InChIKey is BYSGLDCSSWFMAP-KRWDZBQOSA-N. The full InChI is InChI=1S/C21H23N3O2/c25-20-12-17(14-24(20)18-8-4-5-9-18)21(26)23-19-11-10-16(13-22-19)15-6-2-1-3-7-15/h1-3,6-7,10-11,13,17-18H,4-5,8-9,12,14H2,(H,22,23,26)/t17-/m0/s1.
What are the key properties of (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide?
(3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide has a molecular weight of 349.43 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-cyclopentyl-5-oxo-N-(5-phenyl-2-pyridinyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 97082968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).