N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide

C15H22N2O — CID 55177665

IUPACN-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide
SMILESCC(C)Nc1ccccc1C(=O)N(C)CC1CC1
InChIInChI=1S/C15H22N2O/c1-11(2)16-14-7-5-4-6-13(14)15(18)17(3)10-12-8-9-12/h4-7,11-12,16H,8-10H2,1-3H3
InChIKeyREYDXQHFSUZERE-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.99
Rot. Bonds5

About N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide

N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide (PubChem CID 55177665) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide
PubChem CID55177665
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide
SMILESCC(C)Nc1ccccc1C(=O)N(C)CC1CC1
InChIInChI=1S/C15H22N2O/c1-11(2)16-14-7-5-4-6-13(14)15(18)17(3)10-12-8-9-12/h4-7,11-12,16H,8-10H2,1-3H3
InChIKeyREYDXQHFSUZERE-UHFFFAOYSA-N
XLogP2.99
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(cyclopentylmethyl)-2-hydrazinyl-N-methylbenzamide
CID 63656583
N-(cyclobutylmethyl)-N-ethyl-2-(propan-2-ylamino)benzamide
CID 107400011
N-(cyclopropylmethyl)-2-(propan-2-ylamino)benzamide
CID 63107544
N-methyl-2-(propan-2-ylamino)-N-(2,2,2-trifluoroethyl)benzamide
CID 55177472
N-(2-methoxyethyl)-N-methyl-2-(propan-2-ylamino)benzamide
CID 63108038
methyl 3-[methyl-[2-(propan-2-ylamino)benzoyl]amino]propanoate
CID 63108513
N-cyclopropyl-2-(propan-2-ylamino)-N-(2,2,2-trifluoroethyl)benzamide
CID 63108556
N-[(1-methylpiperidin-3-yl)methyl]-2-(propan-2-ylamino)benzamide
CID 63108415
N-(cyclohexylmethyl)-2-[(4-fluorophenyl)sulfonylamino]-N-methylbenzamide
CID 39567590
N-(cyclopropylmethyl)-2-hydrazinyl-N-methylpyridine-3-carboxamide
CID 62235862
N-(cyclobutylmethyl)-3-hydroxy-N,2-dimethylbenzamide
CID 82829035
N-(cyclopentylmethyl)-3-hydroxy-N,2-dimethylbenzamide
CID 82828965

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide?
The IUPAC name of N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide (CID 55177665) is N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide is CC(C)Nc1ccccc1C(=O)N(C)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide?
The InChIKey is REYDXQHFSUZERE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11(2)16-14-7-5-4-6-13(14)15(18)17(3)10-12-8-9-12/h4-7,11-12,16H,8-10H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide?
N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide has a molecular weight of 246.35 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-methyl-2-(propan-2-ylamino)benzamide is sourced from PubChem (CID 55177665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).