2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide

C23H23NO4 — CID 9118748

IUPAC2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide
SMILESCOc1ccc([C@@H](NC(=O)c2cc(OC)ccc2OC)c2ccccc2)cc1
InChIInChI=1S/C23H23NO4/c1-26-18-11-9-17(10-12-18)22(16-7-5-4-6-8-16)24-23(25)20-15-19(27-2)13-14-21(20)28-3/h4-15,22H,1-3H3,(H,24,25)/t22-/m0/s1
InChIKeySYIBKYWIXGVQPD-QFIPXVFZSA-N
MW377.44 g/mol
LogP4.23
Rot. Bonds7

About 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide

2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide (PubChem CID 9118748) has the molecular formula C23H23NO4 and a molecular weight of 377.44 g/mol. Its IUPAC name is 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide.

Molecular Properties

Compound Name2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide
PubChem CID9118748
Molecular FormulaC23H23NO4
Molecular Weight377.44 g/mol
Exact Mass377.16
IUPAC Name2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide
SMILESCOc1ccc([C@@H](NC(=O)c2cc(OC)ccc2OC)c2ccccc2)cc1
InChIInChI=1S/C23H23NO4/c1-26-18-11-9-17(10-12-18)22(16-7-5-4-6-8-16)24-23(25)20-15-19(27-2)13-14-21(20)28-3/h4-15,22H,1-3H3,(H,24,25)/t22-/m0/s1
InChIKeySYIBKYWIXGVQPD-QFIPXVFZSA-N
XLogP4.23
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.44
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[furan-2-yl(phenyl)methyl]-2,5-dimethoxybenzamide
CID 51217853
N-[(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide
CID 2949574
N-[(R)-(4-methoxyphenyl)-phenylmethyl]-2-methylbenzamide
CID 976350
2,5-dichloro-N-[(4-methoxyphenyl)-phenylmethyl]benzamide
CID 16559317
4-methoxy-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 26174053
N-[(4-methoxyphenyl)-phenylmethyl]-2,6-dimethylpyridine-3-carboxamide
CID 55875751
2,5-dimethoxy-N-[(2R)-2-phenylpropyl]benzamide
CID 8624150
(2S)-2-[(2,5-dimethoxybenzoyl)amino]-3-methylbutanoic acid
CID 61137607
[(S)-(4-methoxyphenyl)-phenylmethyl]urea
CID 870966
N-[1-benzofuran-2-yl(phenyl)methyl]-2,4-dimethoxybenzamide
CID 43035801
2,3,4,5,6-pentafluoro-N-[(R)-(4-methoxyphenyl)-phenylmethyl]benzamide
CID 2190610
N-but-3-yn-2-yl-2,5-dimethoxybenzamide
CID 114389664

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide?
The IUPAC name of 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide (CID 9118748) is 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide.
What is the SMILES notation for 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide?
The canonical SMILES for 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide is COc1ccc([C@@H](NC(=O)c2cc(OC)ccc2OC)c2ccccc2)cc1.
What is the InChIKey of 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide?
The InChIKey is SYIBKYWIXGVQPD-QFIPXVFZSA-N. The full InChI is InChI=1S/C23H23NO4/c1-26-18-11-9-17(10-12-18)22(16-7-5-4-6-8-16)24-23(25)20-15-19(27-2)13-14-21(20)28-3/h4-15,22H,1-3H3,(H,24,25)/t22-/m0/s1.
What are the key properties of 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide?
2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide has a molecular weight of 377.44 g/mol, XLogP of 4.23, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-[(S)-(4-methoxyphenyl)-phenylmethyl]benzamide is sourced from PubChem (CID 9118748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).