3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride

C15H23ClN2O — CID 119790806

IUPAC3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride
SMILESCC1CC(NC(=O)C(C)C(N)c2ccccc2)C1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-10-8-13(9-10)17-15(18)11(2)14(16)12-6-4-3-5-7-12;/h3-7,10-11,13-14H,8-9,16H2,1-2H3,(H,17,18);1H
InChIKeyNCIHIBZAHNAHBD-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.66
Rot. Bonds4

About 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride

3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride (PubChem CID 119790806) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride
PubChem CID119790806
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride
SMILESCC1CC(NC(=O)C(C)C(N)c2ccccc2)C1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-10-8-13(9-10)17-15(18)11(2)14(16)12-6-4-3-5-7-12;/h3-7,10-11,13-14H,8-9,16H2,1-2H3,(H,17,18);1H
InChIKeyNCIHIBZAHNAHBD-UHFFFAOYSA-N
XLogP2.66
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-2-methyl-N-(2-methylcyclohexyl)-3-phenylpropanamide;hydrochloride
CID 119676490
3-amino-N-(1,2-dimethylpiperidin-4-yl)-2-methyl-3-phenylpropanamide
CID 81494459
2-chloro-N-(3,5-dimethylcyclohexyl)-2-phenylacetamide
CID 64734444
3-amino-2-methyl-N-(4-methylsulfonylcyclohexyl)-3-phenylpropanamide;hydrochloride
CID 119802914
3-amino-N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-2-methyl-3-phenylpropanamide
CID 119900314
3-amino-N-(3-methylcyclobutyl)-2-phenylpropanamide
CID 113266937
2-amino-N-(3,5-dimethylcyclohexyl)-3-phenylpropanamide
CID 64732718
3-amino-N-[1-(cyclopropylmethyl)piperidin-4-yl]-2-methyl-3-phenylpropanamide;dihydrochloride
CID 119854205
3-amino-2-methyl-3-phenyl-N-(1-phenylethyl)propanamide;hydrochloride
CID 119669700
3-amino-N-(1-cyclopentylethyl)-2-methyl-3-phenylpropanamide
CID 80552136
3-amino-N-(2,2-diethyl-3-methoxycyclobutyl)-2-methyl-3-phenylpropanamide;hydrochloride
CID 119821917
3-amino-N-[(1R)-1-cyclohexylethyl]-2-methyl-3-phenylpropanamide
CID 81389040

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride?
The IUPAC name of 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride (CID 119790806) is 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride.
What is the SMILES notation for 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride?
The canonical SMILES for 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride is CC1CC(NC(=O)C(C)C(N)c2ccccc2)C1.Cl.
What is the InChIKey of 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride?
The InChIKey is NCIHIBZAHNAHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-10-8-13(9-10)17-15(18)11(2)14(16)12-6-4-3-5-7-12;/h3-7,10-11,13-14H,8-9,16H2,1-2H3,(H,17,18);1H.
What are the key properties of 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride?
3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.66, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methyl-N-(3-methylcyclobutyl)-3-phenylpropanamide;hydrochloride is sourced from PubChem (CID 119790806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).