N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide

C16H24N2O — CID 62509873

IUPACN-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)N(C)CC1CC1
InChIInChI=1S/C16H24N2O/c1-4-9-17-15-8-5-12(2)10-14(15)16(19)18(3)11-13-6-7-13/h5,8,10,13,17H,4,6-7,9,11H2,1-3H3
InChIKeyKCWXUMFALABAKW-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.30
Rot. Bonds6

About N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide

N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide (PubChem CID 62509873) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide
PubChem CID62509873
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)N(C)CC1CC1
InChIInChI=1S/C16H24N2O/c1-4-9-17-15-8-5-12(2)10-14(15)16(19)18(3)11-13-6-7-13/h5,8,10,13,17H,4,6-7,9,11H2,1-3H3
InChIKeyKCWXUMFALABAKW-UHFFFAOYSA-N
XLogP3.30
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,5-dimethyl-N-(2-methylpropyl)-2-(propylamino)benzamide
CID 55083322
N-(cyclobutylmethyl)-2-hydrazinyl-N,5-dimethylbenzamide
CID 62856101
N-(cyclopropylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105068880
N-ethyl-2-(ethylamino)-N,5-dimethylbenzamide
CID 62511241
N-(cyclohexylmethyl)-N-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81238812
N-cyclopropyl-2-(ethylamino)-N,5-dimethylbenzamide
CID 62508986
N-(cyclopropylmethyl)-2-hydrazinyl-5-methyl-N-propylbenzamide
CID 62511311
N-(cyclobutylmethyl)-N-ethyl-4-methyl-2-(propylamino)benzamide
CID 107401376
N-(cyclopentylmethyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105070142
N-cyclohexyl-5-methyl-2-(propylamino)benzamide
CID 62509311
5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide
CID 63500938
5-chloro-N-(cyclopropylmethyl)-N-propan-2-yl-2-(propylamino)benzamide
CID 62176897

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide?
The IUPAC name of N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide (CID 62509873) is N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide?
The canonical SMILES for N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide is CCCNc1ccc(C)cc1C(=O)N(C)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide?
The InChIKey is KCWXUMFALABAKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-4-9-17-15-8-5-12(2)10-14(15)16(19)18(3)11-13-6-7-13/h5,8,10,13,17H,4,6-7,9,11H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide?
N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide has a molecular weight of 260.38 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N,5-dimethyl-2-(propylamino)benzamide is sourced from PubChem (CID 62509873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).