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

C23H21N3O3 — CID 124636540

IUPAC4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cc(N3C[C@H](c4ccccc4)CC3=O)ccn2)cc1
InChIInChI=1S/C23H21N3O3/c1-29-20-9-7-17(8-10-20)23(28)25-21-14-19(11-12-24-21)26-15-18(13-22(26)27)16-5-3-2-4-6-16/h2-12,14,18H,13,15H2,1H3,(H,24,25,28)/t18-/m1/s1
InChIKeyLSPNSVIBSCOCBV-GOSISDBHSA-N
MW387.44 g/mol
LogP3.86
Rot. Bonds5

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

4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide (PubChem CID 124636540) has the molecular formula C23H21N3O3 and a molecular weight of 387.44 g/mol. Its IUPAC name is 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide
PubChem CID124636540
Molecular FormulaC23H21N3O3
Molecular Weight387.44 g/mol
Exact Mass387.16
IUPAC Name4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cc(N3C[C@H](c4ccccc4)CC3=O)ccn2)cc1
InChIInChI=1S/C23H21N3O3/c1-29-20-9-7-17(8-10-20)23(28)25-21-14-19(11-12-24-21)26-15-18(13-22(26)27)16-5-3-2-4-6-16/h2-12,14,18H,13,15H2,1H3,(H,24,25,28)/t18-/m1/s1
InChIKeyLSPNSVIBSCOCBV-GOSISDBHSA-N
XLogP3.86
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.44
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]benzamide
CID 58150102
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-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]cyclohexanecarboxamide
CID 124636526
N-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]-3-phenylprop-2-enamide
CID 76687568
1-(2-chloroethyl)-3-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]urea
CID 124636542
4-methoxy-N-[5-(5-oxo-1-phenylpyrrolidin-3-yl)-1,3,4-oxadiazol-2-yl]benzamide
CID 46393260
1-[(4-fluorophenyl)methyl]-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 58150117
1-[(1-methylpiperidin-2-yl)methyl]-3-[4-(2-oxo-4-phenylpyrrolidin-1-yl)-2-pyridinyl]urea
CID 66971321
1-(4-methoxybenzoyl)-4-phenylpyrrolidin-2-one
CID 3537198
N-[4-(2-anilino-4-pyridinyl)-2-pyridinyl]-4-methoxybenzamide
CID 10475851
4-methoxy-N-[(3R)-1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]benzamide
CID 7548080

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide?
The IUPAC name of 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide (CID 124636540) is 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide?
The canonical SMILES for 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide is COc1ccc(C(=O)Nc2cc(N3C[C@H](c4ccccc4)CC3=O)ccn2)cc1.
What is the InChIKey of 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide?
The InChIKey is LSPNSVIBSCOCBV-GOSISDBHSA-N. The full InChI is InChI=1S/C23H21N3O3/c1-29-20-9-7-17(8-10-20)23(28)25-21-14-19(11-12-24-21)26-15-18(13-22(26)27)16-5-3-2-4-6-16/h2-12,14,18H,13,15H2,1H3,(H,24,25,28)/t18-/m1/s1.
What are the key properties of 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide?
4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide has a molecular weight of 387.44 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[4-[(4S)-2-oxo-4-phenylpyrrolidin-1-yl]-2-pyridinyl]benzamide is sourced from PubChem (CID 124636540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).