N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide

C22H25N3O2 — CID 124636526

IUPACN-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide
SMILESO=C(Nc1cc(N2C[C@H](c3ccccc3)CC2=O)ccn1)C1CCCCC1
InChIInChI=1S/C22H25N3O2/c26-21-13-18(16-7-3-1-4-8-16)15-25(21)19-11-12-23-20(14-19)24-22(27)17-9-5-2-6-10-17/h1,3-4,7-8,11-12,14,17-18H,2,5-6,9-10,13,15H2,(H,23,24,27)/t18-/m1/s1
InChIKeyMOZBIQMFBGYTKM-GOSISDBHSA-N
MW363.46 g/mol
LogP4.12
Rot. Bonds4

About N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide

N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide (PubChem CID 124636526) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide
PubChem CID124636526
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC NameN-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide
SMILESO=C(Nc1cc(N2C[C@H](c3ccccc3)CC2=O)ccn1)C1CCCCC1
InChIInChI=1S/C22H25N3O2/c26-21-13-18(16-7-3-1-4-8-16)15-25(21)19-11-12-23-20(14-19)24-22(27)17-9-5-2-6-10-17/h1,3-4,7-8,11-12,14,17-18H,2,5-6,9-10,13,15H2,(H,23,24,27)/t18-/m1/s1
InChIKeyMOZBIQMFBGYTKM-GOSISDBHSA-N
XLogP4.12
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide with MolForge

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Related Compounds

N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]pyridine-2-carboxamide
CID 58150092
1-tert-butyl-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 58150100
N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]-3-phenylprop-2-enamide
CID 76687568
1-[(1-methylpiperidin-2-yl)methyl]-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 66971321
4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide
CID 58150102
1-(2-chloroethyl)-3-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]urea
CID 124636542
4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide
CID 124636540
1-[(4-fluorophenyl)methyl]-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 58150117
N-[5-(5-oxo-1-phenylpyrrolidin-3-yl)-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide
CID 17203638
(Z)-but-2-enedioic acid;N-pyridin-2-ylcyclohexanecarboxamide;hydrate
CID 174341375
N-(4-bromo-2-pyridinyl)cyclopentanecarboxamide
CID 102674366
(3S)-1-(4-fluorophenyl)-N-(4-methyl-2-pyridinyl)-5-oxopyrrolidine-3-carboxamide
CID 755530

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide?
The IUPAC name of N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide (CID 124636526) is N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide?
The canonical SMILES for N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide is O=C(Nc1cc(N2C[C@H](c3ccccc3)CC2=O)ccn1)C1CCCCC1.
What is the InChIKey of N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide?
The InChIKey is MOZBIQMFBGYTKM-GOSISDBHSA-N. The full InChI is InChI=1S/C22H25N3O2/c26-21-13-18(16-7-3-1-4-8-16)15-25(21)19-11-12-23-20(14-19)24-22(27)17-9-5-2-6-10-17/h1,3-4,7-8,11-12,14,17-18H,2,5-6,9-10,13,15H2,(H,23,24,27)/t18-/m1/s1.
What are the key properties of N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide?
N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide has a molecular weight of 363.46 g/mol, XLogP of 4.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide is sourced from PubChem (CID 124636526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).