N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide

C18H26N2O2 — CID 166847333

IUPACN-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide
SMILESO=C(NC1CCCC1)c1ccc(N2CCC(CO)CC2)cc1
InChIInChI=1S/C18H26N2O2/c21-13-14-9-11-20(12-10-14)17-7-5-15(6-8-17)18(22)19-16-3-1-2-4-16/h5-8,14,16,21H,1-4,9-13H2,(H,19,22)
InChIKeyZSZRLUQELGBGLY-UHFFFAOYSA-N
MW302.42 g/mol
LogP2.57
Rot. Bonds4

About N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide

N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide (PubChem CID 166847333) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide
PubChem CID166847333
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide
SMILESO=C(NC1CCCC1)c1ccc(N2CCC(CO)CC2)cc1
InChIInChI=1S/C18H26N2O2/c21-13-14-9-11-20(12-10-14)17-7-5-15(6-8-17)18(22)19-16-3-1-2-4-16/h5-8,14,16,21H,1-4,9-13H2,(H,19,22)
InChIKeyZSZRLUQELGBGLY-UHFFFAOYSA-N
XLogP2.57
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-4-piperidin-1-ylbenzamide
CID 21368345
N-(2,6-dihydroxypiperidin-3-yl)-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide
CID 176705733
N-cyclopropyl-4-(4-methoxypiperidin-1-yl)benzamide
CID 91813653
N-cyclopentyl-4-[4-[2-(furan-2-yl)ethylamino]piperidin-1-yl]benzamide
CID 42434130
N-cyclopentyl-4-(hydroxymethyl)benzamide
CID 60636896
N-[(3R,5S)-1-(3-chloro-4-cyanophenyl)-5-methylpyrrolidin-3-yl]-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide
CID 166847328
4-(4-hydroxypiperidin-1-yl)-N-(1-propylpiperidin-4-yl)benzamide
CID 111331639
(3S)-1-[4-(cycloheptylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 94467987
3-[4-[(4-piperazin-1-ylbenzoyl)amino]cyclohexyl]propanoic acid
CID 67844654
N-cyclopentyl-4-[4-[(4-pyrazol-1-ylphenyl)methylamino]piperidin-1-yl]benzamide
CID 42485205
N-cyclopentyl-4-[4-(4-pyrimidin-2-yl-1,4-diazepan-1-yl)piperidin-1-yl]benzamide
CID 42278079
N-[3-(dimethylamino)cyclohexyl]-4-(4-hydroxypiperidin-1-yl)benzamide
CID 111783320

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide?
The IUPAC name of N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide (CID 166847333) is N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide.
What is the SMILES notation for N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide?
The canonical SMILES for N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide is O=C(NC1CCCC1)c1ccc(N2CCC(CO)CC2)cc1.
What is the InChIKey of N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide?
The InChIKey is ZSZRLUQELGBGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c21-13-14-9-11-20(12-10-14)17-7-5-15(6-8-17)18(22)19-16-3-1-2-4-16/h5-8,14,16,21H,1-4,9-13H2,(H,19,22).
What are the key properties of N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide?
N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide has a molecular weight of 302.42 g/mol, XLogP of 2.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[4-(hydroxymethyl)piperidin-1-yl]benzamide is sourced from PubChem (CID 166847333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).