N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide

C19H23NO2 — CID 38002269

IUPACN-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide
SMILESCOc1ccc([C@@H](CC(C)C)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C19H23NO2/c1-14(2)13-18(15-9-11-17(22-3)12-10-15)20-19(21)16-7-5-4-6-8-16/h4-12,14,18H,13H2,1-3H3,(H,20,21)/t18-/m1/s1
InChIKeyBBZLSUQZLOWQQQ-GOSISDBHSA-N
MW297.40 g/mol
LogP4.21
Rot. Bonds6

About N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide

N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide (PubChem CID 38002269) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide
PubChem CID38002269
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide
SMILESCOc1ccc([C@@H](CC(C)C)NC(=O)c2ccccc2)cc1
InChIInChI=1S/C19H23NO2/c1-14(2)13-18(15-9-11-17(22-3)12-10-15)20-19(21)16-7-5-4-6-8-16/h4-12,14,18H,13H2,1-3H3,(H,20,21)/t18-/m1/s1
InChIKeyBBZLSUQZLOWQQQ-GOSISDBHSA-N
XLogP4.21
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-(4-methoxyphenyl)-3-methylbutyl]-4-methylbenzamide
CID 28631733
N-(3-methyl-1-phenylbutyl)benzamide
CID 46770250
4-iodo-N-[1-(4-methoxyphenyl)-3-methylbutyl]benzamide
CID 43875821
N-[1-(4-methoxyphenyl)-3-methylbutyl]-3-methylbenzamide
CID 43916366
N-[1-(4-methoxyphenyl)-3-methylbutyl]-3,4-dimethylbenzamide
CID 133202746
2-iodo-N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide
CID 92677839
1-[(1S)-1-(4-methoxyphenyl)-3-methylbutyl]-3-phenylurea
CID 92685488
(E)-N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]-2,3-diphenylprop-2-enamide
CID 99959671
3-(methanesulfonamido)-N-[(1S)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide
CID 28566637
N-[1-(4-methoxyphenyl)-3-methylbutyl]-2-propan-2-ylsulfanylbenzamide
CID 132655838
N-[1-(4-methoxyphenyl)-3-methylbutyl]-3-(2-methylprop-2-enoxy)benzamide
CID 132655047
N-[(1S)-1-(4-methoxyphenyl)-3-methylbutyl]thiophene-2-carboxamide
CID 93486739

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide?
The IUPAC name of N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide (CID 38002269) is N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide.
What is the SMILES notation for N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide?
The canonical SMILES for N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide is COc1ccc([C@@H](CC(C)C)NC(=O)c2ccccc2)cc1.
What is the InChIKey of N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide?
The InChIKey is BBZLSUQZLOWQQQ-GOSISDBHSA-N. The full InChI is InChI=1S/C19H23NO2/c1-14(2)13-18(15-9-11-17(22-3)12-10-15)20-19(21)16-7-5-4-6-8-16/h4-12,14,18H,13H2,1-3H3,(H,20,21)/t18-/m1/s1.
What are the key properties of N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide?
N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide has a molecular weight of 297.40 g/mol, XLogP of 4.21, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-methoxyphenyl)-3-methylbutyl]benzamide is sourced from PubChem (CID 38002269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).