N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide

C12H16N2O2 — CID 103751246

IUPACN-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide
SMILESO=C(NC1CCCC1CO)c1ccncc1
InChIInChI=1S/C12H16N2O2/c15-8-10-2-1-3-11(10)14-12(16)9-4-6-13-7-5-9/h4-7,10-11,15H,1-3,8H2,(H,14,16)
InChIKeyJAHOFJBTUNHRGL-UHFFFAOYSA-N
MW220.27 g/mol
LogP0.97
Rot. Bonds3

About N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide

N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide (PubChem CID 103751246) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide
PubChem CID103751246
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC NameN-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide
SMILESO=C(NC1CCCC1CO)c1ccncc1
InChIInChI=1S/C12H16N2O2/c15-8-10-2-1-3-11(10)14-12(16)9-4-6-13-7-5-9/h4-7,10-11,15H,1-3,8H2,(H,14,16)
InChIKeyJAHOFJBTUNHRGL-UHFFFAOYSA-N
XLogP0.97
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(bromomethyl)cyclohexyl]pyridine-4-carboxamide
CID 106367080
4-amino-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 113266858
N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 85447885
4-N-[2-(hydroxymethyl)cyclohexyl]benzene-1,4-dicarboxamide
CID 103798607
2-(aminomethyl)-N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide
CID 104844483
N-[(1R,2R,3R)-2,3-dihydroxycycloheptyl]pyridine-4-carboxamide
CID 110125810
N-(2-methylcyclohexyl)pyridine-4-carboxamide
CID 24819408
4-(chloromethyl)-N-[2-(hydroxymethyl)cyclohexyl]benzamide
CID 106359879
4-ethoxy-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103751428
3,5-dibromo-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103909256
4-butyl-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103774443
N-cyclopentylpyridine-4-carboxamide
CID 4212000

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide (CID 103751246) is N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide is O=C(NC1CCCC1CO)c1ccncc1.
What is the InChIKey of N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide?
The InChIKey is JAHOFJBTUNHRGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c15-8-10-2-1-3-11(10)14-12(16)9-4-6-13-7-5-9/h4-7,10-11,15H,1-3,8H2,(H,14,16).
What are the key properties of N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide?
N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide has a molecular weight of 220.27 g/mol, XLogP of 0.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclopentyl]pyridine-4-carboxamide is sourced from PubChem (CID 103751246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).