N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide

C17H27N3O — CID 63316486

IUPACN-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide
SMILESCCNc1ccc(C(=O)NCCN(C)C2CCCC2)cc1
InChIInChI=1S/C17H27N3O/c1-3-18-15-10-8-14(9-11-15)17(21)19-12-13-20(2)16-6-4-5-7-16/h8-11,16,18H,3-7,12-13H2,1-2H3,(H,19,21)
InChIKeyPOCJRTKUFNXBEK-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.72
Rot. Bonds7

About N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide

N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide (PubChem CID 63316486) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide.

Molecular Properties

Compound NameN-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide
PubChem CID63316486
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide
SMILESCCNc1ccc(C(=O)NCCN(C)C2CCCC2)cc1
InChIInChI=1S/C17H27N3O/c1-3-18-15-10-8-14(9-11-15)17(21)19-12-13-20(2)16-6-4-5-7-16/h8-11,16,18H,3-7,12-13H2,1-2H3,(H,19,21)
InChIKeyPOCJRTKUFNXBEK-UHFFFAOYSA-N
XLogP2.72
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[cyclopentyl(methyl)amino]ethyl]-3,4-dihydroxybenzamide
CID 103956034
4-[[2-[cyclohexyl(methyl)amino]-2-oxoethyl]amino]-N-ethylbenzamide
CID 54839256
N-[2-[cyclopentyl(methyl)amino]ethyl]-3-hydroxy-4-iodobenzamide
CID 104628315
N-(cyclopropylmethyl)-4-(ethylamino)benzamide
CID 62173113
N-[2-[cyclohexyl(methyl)amino]ethyl]-3-methylbenzamide
CID 121420012
N-[2-[cyclopentyl(methyl)amino]ethyl]-5-(ethylamino)-1,3,4-thiadiazole-2-carboxamide
CID 80616910
N-[2-[cyclopropyl(methyl)amino]ethyl]-4-(ethylamino)pyridine-2-carboxamide
CID 62978567
3-[2-[cyclopentyl(methyl)amino]ethyl]-1-ethyl-1-methylurea
CID 115613946
4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide
CID 62179470
N-[2-[acetyl(cyclohexyl)amino]ethyl]-4-methylbenzamide
CID 113052915
4-N-cycloheptyl-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045756
N-(2-cyclohexylethyl)-4-(propylamino)benzamide
CID 62180221

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide?
The IUPAC name of N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide (CID 63316486) is N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide.
What is the SMILES notation for N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide?
The canonical SMILES for N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide is CCNc1ccc(C(=O)NCCN(C)C2CCCC2)cc1.
What is the InChIKey of N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide?
The InChIKey is POCJRTKUFNXBEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-3-18-15-10-8-14(9-11-15)17(21)19-12-13-20(2)16-6-4-5-7-16/h8-11,16,18H,3-7,12-13H2,1-2H3,(H,19,21).
What are the key properties of N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide?
N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide has a molecular weight of 289.42 g/mol, XLogP of 2.72, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopentyl(methyl)amino]ethyl]-4-(ethylamino)benzamide is sourced from PubChem (CID 63316486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).