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

C15H23ClN2O — CID 119770662

IUPAC3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride
SMILESCN(CC1CCC1)C(=O)C(CN)c1ccccc1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-17(11-12-6-5-7-12)15(18)14(10-16)13-8-3-2-4-9-13;/h2-4,8-9,12,14H,5-7,10-11,16H2,1H3;1H
InChIKeyHAGMJSVELZHBSS-UHFFFAOYSA-N
MW282.81 g/mol
LogP2.41
Rot. Bonds5

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

3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride (PubChem CID 119770662) has the molecular formula C15H23ClN2O and a molecular weight of 282.81 g/mol. Its IUPAC name is 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride
PubChem CID119770662
Molecular FormulaC15H23ClN2O
Molecular Weight282.81 g/mol
Exact Mass282.15
IUPAC Name3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride
SMILESCN(CC1CCC1)C(=O)C(CN)c1ccccc1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-17(11-12-6-5-7-12)15(18)14(10-16)13-8-3-2-4-9-13;/h2-4,8-9,12,14H,5-7,10-11,16H2,1H3;1H
InChIKeyHAGMJSVELZHBSS-UHFFFAOYSA-N
XLogP2.41
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.81
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide
CID 62878205
3-amino-N-methyl-N-(oxan-2-ylmethyl)-2-phenylpropanamide
CID 62876627
3-amino-N-(2-amino-2-oxoethyl)-N-methyl-2-phenylpropanamide
CID 62877301
2-[(3-amino-2-phenylpropanoyl)-(cyclopropylmethyl)amino]acetic acid
CID 62878549
(2S)-3-amino-N,N-dimethyl-2-phenylpropanamide
CID 94888711
3-amino-N-(cyclopropylmethyl)-N,2-dimethyl-3-phenylpropanamide;hydrochloride
CID 119737873
3-amino-N-benzyl-N-methyl-2-phenylpropanamide
CID 62878331
3-amino-N-[(2-hydroxyphenyl)methyl]-N-methyl-2-phenylpropanamide
CID 62878721
3-amino-N-methyl-N-(2-methylcyclohexyl)-2-phenylpropanamide
CID 62877491
methyl 3-[cyclobutylmethyl(methyl)amino]-2-phenylpropanoate
CID 64567717
3-amino-N-methyl-2-phenyl-N-(pyridin-3-ylmethyl)propanamide;dihydrochloride
CID 119958250
3-amino-N-(cyclohexylmethyl)-N-methyl-3-phenylpropanamide
CID 60963492

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride?
The IUPAC name of 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride (CID 119770662) is 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride.
What is the SMILES notation for 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride?
The canonical SMILES for 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride is CN(CC1CCC1)C(=O)C(CN)c1ccccc1.Cl.
What is the InChIKey of 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride?
The InChIKey is HAGMJSVELZHBSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-17(11-12-6-5-7-12)15(18)14(10-16)13-8-3-2-4-9-13;/h2-4,8-9,12,14H,5-7,10-11,16H2,1H3;1H.
What are the key properties of 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride?
3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride has a molecular weight of 282.81 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(cyclobutylmethyl)-N-methyl-2-phenylpropanamide;hydrochloride is sourced from PubChem (CID 119770662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).