N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide

C15H22N2O — CID 55241758

IUPACN-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide
SMILESCc1cccc(C(=O)N(CCN)C2CCCC2)c1
InChIInChI=1S/C15H22N2O/c1-12-5-4-6-13(11-12)15(18)17(10-9-16)14-7-2-3-8-14/h4-6,11,14H,2-3,7-10,16H2,1H3
InChIKeyVHNDBLSSSFQIJN-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.34
Rot. Bonds4

About N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide

N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide (PubChem CID 55241758) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide
PubChem CID55241758
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide
SMILESCc1cccc(C(=O)N(CCN)C2CCCC2)c1
InChIInChI=1S/C15H22N2O/c1-12-5-4-6-13(11-12)15(18)17(10-9-16)14-7-2-3-8-14/h4-6,11,14H,2-3,7-10,16H2,1H3
InChIKeyVHNDBLSSSFQIJN-UHFFFAOYSA-N
XLogP2.34
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminoethyl)-N-cyclopentyl-3,5-dimethylbenzamide
CID 63755882
N-(2-aminoethyl)-N-cyclopentyl-3-fluoro-4-methylbenzamide
CID 63755708
3-[cyclopropyl-(3-methylbenzoyl)amino]propanoic acid
CID 54926450
N-(2-aminoethyl)-N-cyclopentyl-2-(3-methylphenyl)acetamide
CID 63754808
N-(2-aminoethyl)-N-cyclopropyl-3-hydroxybenzamide
CID 61349964
N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide
CID 106754373
N-(3-aminopropyl)-N-cycloheptyl-3-fluorobenzamide
CID 43319433
N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide
CID 43319405
N-(2-aminoethyl)-N-cyclopentyl-5-methyl-1-benzofuran-2-carboxamide
CID 63753713
N-(2-aminoethyl)-N-cyclobutyl-3-hydroxy-2-methylbenzamide
CID 102874159
N-(2-aminoethyl)-N-cyclopentyl-4-propan-2-ylbenzamide
CID 63755155
N-cyclopropyl-3-methyl-N-(pyrrolidin-2-ylmethyl)benzamide
CID 104974147

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide (CID 55241758) is N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide is Cc1cccc(C(=O)N(CCN)C2CCCC2)c1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide?
The InChIKey is VHNDBLSSSFQIJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-5-4-6-13(11-12)15(18)17(10-9-16)14-7-2-3-8-14/h4-6,11,14H,2-3,7-10,16H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide?
N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide has a molecular weight of 246.35 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide is sourced from PubChem (CID 55241758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).