3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide

C16H15Cl2NO2 — CID 9033034

IUPAC3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide
SMILESCOc1c(Cl)cc(C(=O)N[C@H](C)c2ccccc2)cc1Cl
InChIInChI=1S/C16H15Cl2NO2/c1-10(11-6-4-3-5-7-11)19-16(20)12-8-13(17)15(21-2)14(18)9-12/h3-10H,1-2H3,(H,19,20)/t10-/m1/s1
InChIKeyAHDSFGVVBHOVTC-SNVBAGLBSA-N
MW324.21 g/mol
LogP4.49
Rot. Bonds4

About 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide

3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide (PubChem CID 9033034) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide
PubChem CID9033034
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide
SMILESCOc1c(Cl)cc(C(=O)N[C@H](C)c2ccccc2)cc1Cl
InChIInChI=1S/C16H15Cl2NO2/c1-10(11-6-4-3-5-7-11)19-16(20)12-8-13(17)15(21-2)14(18)9-12/h3-10H,1-2H3,(H,19,20)/t10-/m1/s1
InChIKeyAHDSFGVVBHOVTC-SNVBAGLBSA-N
XLogP4.49
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 2,6-dichloro-4-[[(1R)-1-phenylethyl]carbamoyl]benzoate
CID 166506945
3,5-dichloro-4-methoxy-N-[1-(3-nitrophenyl)ethyl]benzamide
CID 55924817
3,6-dichloro-2-methoxy-N-(1-phenylethyl)benzamide
CID 2788458
N-[1-(3-bromophenyl)ethyl]-3-chloro-4,5-dimethoxybenzamide
CID 43059210
3,5-dimethoxy-4-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 2557457
N'-benzoyl-3,5-dichloro-4-methoxybenzohydrazide
CID 51218002
(2R)-2-[(3,5-dichloro-4-methoxybenzoyl)amino]-3-methylbutanoic acid
CID 79011316
3-chloro-N-[1-(3-chlorophenyl)ethyl]-4-ethoxy-5-methoxybenzamide
CID 43010464
3-bromo-4-chloro-N-[(1R)-1-phenylethyl]benzamide
CID 59803164
5-(1-phenylethylcarbamoyl)benzene-1,3-dicarboxylic acid;sulfanylidenephosphane
CID 159120234
3,5-dichloro-4-methoxy-N-(3-propan-2-ylphenyl)benzamide
CID 18276879
3-chloro-4,5-dimethoxy-N-[(2R)-2-phenylpropyl]benzamide
CID 9301624

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide?
The IUPAC name of 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide (CID 9033034) is 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide.
What is the SMILES notation for 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide?
The canonical SMILES for 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide is COc1c(Cl)cc(C(=O)N[C@H](C)c2ccccc2)cc1Cl.
What is the InChIKey of 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide?
The InChIKey is AHDSFGVVBHOVTC-SNVBAGLBSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-10(11-6-4-3-5-7-11)19-16(20)12-8-13(17)15(21-2)14(18)9-12/h3-10H,1-2H3,(H,19,20)/t10-/m1/s1.
What are the key properties of 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide?
3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide has a molecular weight of 324.21 g/mol, XLogP of 4.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4-methoxy-N-[(1R)-1-phenylethyl]benzamide is sourced from PubChem (CID 9033034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).