(2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone

C15H21N3O2 — CID 110013765

IUPAC(2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone
SMILESO=C(C1CCCC1O)N1CCN(c2ccncc2)CC1
InChIInChI=1S/C15H21N3O2/c19-14-3-1-2-13(14)15(20)18-10-8-17(9-11-18)12-4-6-16-7-5-12/h4-7,13-14,19H,1-3,8-11H2
InChIKeyAZUKDYCUGHJSOP-UHFFFAOYSA-N
MW275.35 g/mol
LogP0.89
Rot. Bonds2

About (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone

(2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone (PubChem CID 110013765) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone.

Molecular Properties

Compound Name(2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone
PubChem CID110013765
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name(2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone
SMILESO=C(C1CCCC1O)N1CCN(c2ccncc2)CC1
InChIInChI=1S/C15H21N3O2/c19-14-3-1-2-13(14)15(20)18-10-8-17(9-11-18)12-4-6-16-7-5-12/h4-7,13-14,19H,1-3,8-11H2
InChIKeyAZUKDYCUGHJSOP-UHFFFAOYSA-N
XLogP0.89
TPSA56.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-hydroxycyclopentyl)-(4-phenylpiperazin-1-yl)methanone
CID 110013572
cyclopropyl-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 110868344
(2-hydroxycyclopentyl)-[4-(pyridin-4-ylmethyl)piperazin-1-yl]methanone
CID 110013764
[4-(4-aminophenyl)piperazin-1-yl]-(2-methylcyclopentyl)methanone
CID 107174788
cyclobutyl-[4-(4-piperidin-1-ylphenyl)piperazin-1-yl]methanone
CID 113079016
[(1S,2S)-2-(4-fluorophenyl)cyclopropyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 94532811
2-(4-phenylpiperazine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 2933500
cis-(1R,2S)-2-[4-(4-chlorophenyl)piperazine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 7308003
trans-(1S,2S)-2-[4-(4-fluorophenyl)piperazine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 873868
cis-(1R,2S)-2-[4-(4-fluorophenyl)piperazine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 873866
2-[4-(4-fluorophenyl)piperazine-1-carbonyl]cyclohexane-1-carboxylic acid
CID 2886463
[(1R,2R)-2-(furan-2-yl)cyclopropyl]-(4-pyridin-4-ylpiperazin-1-yl)methanone
CID 95588176

Frequently Asked Questions

What is the IUPAC name of (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone?
The IUPAC name of (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone (CID 110013765) is (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone.
What is the SMILES notation for (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone?
The canonical SMILES for (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone is O=C(C1CCCC1O)N1CCN(c2ccncc2)CC1.
What is the InChIKey of (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone?
The InChIKey is AZUKDYCUGHJSOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c19-14-3-1-2-13(14)15(20)18-10-8-17(9-11-18)12-4-6-16-7-5-12/h4-7,13-14,19H,1-3,8-11H2.
What are the key properties of (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone?
(2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone has a molecular weight of 275.35 g/mol, XLogP of 0.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-hydroxycyclopentyl)-(4-pyridin-4-ylpiperazin-1-yl)methanone is sourced from PubChem (CID 110013765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).