N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride

C19H25ClN2O — CID 119608679

IUPACN-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride
SMILESCC(C)C(C)(CN)NC(=O)c1ccc(-c2ccccc2)cc1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-14(2)19(3,13-20)21-18(22)17-11-9-16(10-12-17)15-7-5-4-6-8-15;/h4-12,14H,13,20H2,1-3H3,(H,21,22);1H
InChIKeyWCUFCNQMHRCLAG-UHFFFAOYSA-N
MW332.88 g/mol
LogP3.88
Rot. Bonds5

About N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride

N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride (PubChem CID 119608679) has the molecular formula C19H25ClN2O and a molecular weight of 332.88 g/mol. Its IUPAC name is N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride
PubChem CID119608679
Molecular FormulaC19H25ClN2O
Molecular Weight332.88 g/mol
Exact Mass332.17
IUPAC NameN-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride
SMILESCC(C)C(C)(CN)NC(=O)c1ccc(-c2ccccc2)cc1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-14(2)19(3,13-20)21-18(22)17-11-9-16(10-12-17)15-7-5-4-6-8-15;/h4-12,14H,13,20H2,1-3H3,(H,21,22);1H
InChIKeyWCUFCNQMHRCLAG-UHFFFAOYSA-N
XLogP3.88
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.88
LogP ≤ 53.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 119607871
N-(1-amino-2,3-dimethylbutan-2-yl)naphthalene-2-carboxamide
CID 81486115
N-(1-amino-2,3-dimethylbutan-2-yl)-4-(2-methylpropanoylamino)benzamide;hydrochloride
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N-(1-amino-2,3-dimethylbutan-2-yl)-4-nitrobenzamide;hydrochloride
CID 119605451
N-(1-amino-2,3-dimethylbutan-2-yl)-3,4-dimethylbenzamide;hydrochloride
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N-(1-amino-2,3-dimethylbutan-2-yl)-4-(difluoromethylsulfanyl)benzamide
CID 119607400
N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenylacetamide;hydrochloride
CID 119608428
N-(1-amino-2,3-dimethylbutan-2-yl)-5-phenyl-1,2-oxazole-3-carboxamide;hydrochloride
CID 119606599
N-(1-amino-2,3-dimethylbutan-2-yl)-5-methyl-1-(4-phenylphenyl)triazole-4-carboxamide;hydrochloride
CID 119607707
N-(1-amino-2,3-dimethylbutan-2-yl)-3-fluorobenzamide;hydrochloride
CID 119605448
N-(1-amino-2,3-dimethylbutan-2-yl)-3-iodobenzamide;hydrochloride
CID 119605904
N-(1-amino-2,3-dimethylbutan-2-yl)-2,3-dioxo-1,4-dihydroquinoxaline-6-carboxamide;hydrochloride
CID 119607727

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride?
The IUPAC name of N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride (CID 119608679) is N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride.
What is the SMILES notation for N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride?
The canonical SMILES for N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride is CC(C)C(C)(CN)NC(=O)c1ccc(-c2ccccc2)cc1.Cl.
What is the InChIKey of N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride?
The InChIKey is WCUFCNQMHRCLAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O.ClH/c1-14(2)19(3,13-20)21-18(22)17-11-9-16(10-12-17)15-7-5-4-6-8-15;/h4-12,14H,13,20H2,1-3H3,(H,21,22);1H.
What are the key properties of N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride?
N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride has a molecular weight of 332.88 g/mol, XLogP of 3.88, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dimethylbutan-2-yl)-4-phenylbenzamide;hydrochloride is sourced from PubChem (CID 119608679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).