4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide

C21H24N2O3 — CID 110286844

IUPAC4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide
SMILESCOc1ccc(C(=O)N[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1
InChIInChI=1S/C21H24N2O3/c1-26-18-12-10-17(11-13-18)20(24)22-19(16-8-4-2-5-9-16)21(25)23-14-6-3-7-15-23/h2,4-5,8-13,19H,3,6-7,14-15H2,1H3,(H,22,24)/t19-/m0/s1
InChIKeyLKJZPVZUQUGIFD-IBGZPJMESA-N
MW352.43 g/mol
LogP3.18
Rot. Bonds5

About 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide

4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide (PubChem CID 110286844) has the molecular formula C21H24N2O3 and a molecular weight of 352.43 g/mol. Its IUPAC name is 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide.

Molecular Properties

Compound Name4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide
PubChem CID110286844
Molecular FormulaC21H24N2O3
Molecular Weight352.43 g/mol
Exact Mass352.18
IUPAC Name4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide
SMILESCOc1ccc(C(=O)N[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1
InChIInChI=1S/C21H24N2O3/c1-26-18-12-10-17(11-13-18)20(24)22-19(16-8-4-2-5-9-16)21(25)23-14-6-3-7-15-23/h2,4-5,8-13,19H,3,6-7,14-15H2,1H3,(H,22,24)/t19-/m0/s1
InChIKeyLKJZPVZUQUGIFD-IBGZPJMESA-N
XLogP3.18
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.43
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-N-[(1S)-2-(4-methylpiperazin-1-yl)-2-oxo-1-phenylethyl]benzamide
CID 110287010
4-methoxy-N-[2-[4-(methylamino)piperidin-1-yl]-2-oxo-1-phenylethyl]benzamide;hydrochloride
CID 119562927
(E)-3-(4-methoxyphenyl)-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]but-2-enamide
CID 110306126
4-methoxy-N-[2-oxo-1-phenyl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]ethyl]benzamide;hydrochloride
CID 10139436
4-N-(2-oxo-1-phenyl-2-piperidin-1-ylethyl)benzene-1,4-dicarboxamide
CID 90833775
(2R)-2-[(4-methoxybenzoyl)amino]-2-phenylacetate
CID 6948068
4-chloro-N-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 110286769
4-methoxy-N-(1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl)benzamide
CID 5021960
N-(2-amino-2-oxo-1-phenylethyl)-4-methoxybenzamide
CID 51315270
3,5-dimethoxy-N-[(1S)-2-(4-methylpiperazin-1-yl)-2-oxo-1-phenylethyl]benzamide
CID 110287011
N-[2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-2-oxo-1-phenylethyl]-4-methoxybenzamide;hydrochloride
CID 120807240
4-methoxy-N-[(2S)-3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl]benzamide
CID 7997539

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide?
The IUPAC name of 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide (CID 110286844) is 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide.
What is the SMILES notation for 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide?
The canonical SMILES for 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide is COc1ccc(C(=O)N[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1.
What is the InChIKey of 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide?
The InChIKey is LKJZPVZUQUGIFD-IBGZPJMESA-N. The full InChI is InChI=1S/C21H24N2O3/c1-26-18-12-10-17(11-13-18)20(24)22-19(16-8-4-2-5-9-16)21(25)23-14-6-3-7-15-23/h2,4-5,8-13,19H,3,6-7,14-15H2,1H3,(H,22,24)/t19-/m0/s1.
What are the key properties of 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide?
4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide has a molecular weight of 352.43 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]benzamide is sourced from PubChem (CID 110286844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).