N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide

C19H28N2O — CID 110752030

IUPACN-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide
SMILESCc1ccc(C(=O)NC2CCN(C3CCCC3)CC2)cc1C
InChIInChI=1S/C19H28N2O/c1-14-7-8-16(13-15(14)2)19(22)20-17-9-11-21(12-10-17)18-5-3-4-6-18/h7-8,13,17-18H,3-6,9-12H2,1-2H3,(H,20,22)
InChIKeyQWNFTGNYSPJSKL-UHFFFAOYSA-N
MW300.45 g/mol
LogP3.44
Rot. Bonds3

About N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide

N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide (PubChem CID 110752030) has the molecular formula C19H28N2O and a molecular weight of 300.45 g/mol. Its IUPAC name is N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide
PubChem CID110752030
Molecular FormulaC19H28N2O
Molecular Weight300.45 g/mol
Exact Mass300.22
IUPAC NameN-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide
SMILESCc1ccc(C(=O)NC2CCN(C3CCCC3)CC2)cc1C
InChIInChI=1S/C19H28N2O/c1-14-7-8-16(13-15(14)2)19(22)20-17-9-11-21(12-10-17)18-5-3-4-6-18/h7-8,13,17-18H,3-6,9-12H2,1-2H3,(H,20,22)
InChIKeyQWNFTGNYSPJSKL-UHFFFAOYSA-N
XLogP3.44
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-(1-cyclopropylpiperidin-4-yl)-3-methylbenzamide
CID 43711761
N-cyclobutyl-3,4-dimethylbenzamide;ethane
CID 142916267
N-(1-ethylpiperidin-4-yl)-3,4-dimethylbenzamide
CID 17249701
5-amino-N-(1-cyclopentylpiperidin-4-yl)-2-methylbenzamide
CID 120641743
3-amino-N-(1-cyclopentylpiperidin-4-yl)benzamide
CID 119846678
3-amino-N-(1-cyclohexylpiperidin-4-yl)benzamide
CID 119895195
N-(1-cyclopropylpiperidin-4-yl)-4-iodobenzamide
CID 60730497
3-(1-cyclobutylpiperidin-4-yl)oxy-N-cyclopropyl-4-methoxybenzamide
CID 42120029
N-[1-(3,5-dihydroxybenzoyl)piperidin-4-yl]-3,4-dimethylbenzamide
CID 108557638
3,4-dimethyl-N-(1-pyrimidin-2-ylpiperidin-4-yl)benzamide
CID 110712544
N-cyclohexyl-4-hydroxy-3-methylbenzamide
CID 113355938
4-amino-N-cyclohexyl-3-methylbenzamide
CID 16773559

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide?
The IUPAC name of N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide (CID 110752030) is N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide.
What is the SMILES notation for N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide?
The canonical SMILES for N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide is Cc1ccc(C(=O)NC2CCN(C3CCCC3)CC2)cc1C.
What is the InChIKey of N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide?
The InChIKey is QWNFTGNYSPJSKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O/c1-14-7-8-16(13-15(14)2)19(22)20-17-9-11-21(12-10-17)18-5-3-4-6-18/h7-8,13,17-18H,3-6,9-12H2,1-2H3,(H,20,22).
What are the key properties of N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide?
N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide has a molecular weight of 300.45 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopentylpiperidin-4-yl)-3,4-dimethylbenzamide is sourced from PubChem (CID 110752030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).