4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride

C15H23ClN2O — CID 119292306

IUPAC4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride
SMILESCC(C)CN(C(=O)c1ccc(CN)cc1)C1CC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11(2)10-17(14-7-8-14)15(18)13-5-3-12(9-16)4-6-13;/h3-6,11,14H,7-10,16H2,1-2H3;1H
InChIKeyJMLGRYWXKUXBLS-UHFFFAOYSA-N
MW282.82 g/mol
LogP2.83
Rot. Bonds5

About 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride

4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride (PubChem CID 119292306) has the molecular formula C15H23ClN2O and a molecular weight of 282.82 g/mol. Its IUPAC name is 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride.

Molecular Properties

Compound Name4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride
PubChem CID119292306
Molecular FormulaC15H23ClN2O
Molecular Weight282.82 g/mol
Exact Mass282.15
IUPAC Name4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride
SMILESCC(C)CN(C(=O)c1ccc(CN)cc1)C1CC1.Cl
InChIInChI=1S/C15H22N2O.ClH/c1-11(2)10-17(14-7-8-14)15(18)13-5-3-12(9-16)4-6-13;/h3-6,11,14H,7-10,16H2,1-2H3;1H
InChIKeyJMLGRYWXKUXBLS-UHFFFAOYSA-N
XLogP2.83
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.82
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Procarbazine
CID 4915
N,N-diethyl-m-toluamide
CID 4284
Procarbazine Hydrochloride
CID 9703
N-Methylbenzamide
CID 11954
N,N-Diethylbenzamide
CID 15542
2-Methyl-N,N-diethylbenzamide
CID 75945
N-Propylbenzamide
CID 25354
AR-M1000390
CID 9841259
N-Ethylbenzamide
CID 11959
N-Butylbenzamide
CID 76024
N-Benzoylbenzylamine
CID 73878
4-methyl-N-(2-phenylethyl)benzamide
CID 723105

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride?
The IUPAC name of 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride (CID 119292306) is 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride.
What is the SMILES notation for 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride?
The canonical SMILES for 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride is CC(C)CN(C(=O)c1ccc(CN)cc1)C1CC1.Cl.
What is the InChIKey of 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride?
The InChIKey is JMLGRYWXKUXBLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O.ClH/c1-11(2)10-17(14-7-8-14)15(18)13-5-3-12(9-16)4-6-13;/h3-6,11,14H,7-10,16H2,1-2H3;1H.
What are the key properties of 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride?
4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride has a molecular weight of 282.82 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-cyclopropyl-N-(2-methylpropyl)benzamide;hydrochloride is sourced from PubChem (CID 119292306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).