2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol

C18H28N2O — CID 114339826

IUPAC2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol
SMILESCc1cccnc1CN1CCCCC1C1CCCCC1O
InChIInChI=1S/C18H28N2O/c1-14-7-6-11-19-16(14)13-20-12-5-4-9-17(20)15-8-2-3-10-18(15)21/h6-7,11,15,17-18,21H,2-5,8-10,12-13H2,1H3
InChIKeyDHNMYQGJLQJWLU-UHFFFAOYSA-N
MW288.43 g/mol
LogP3.30
Rot. Bonds3

About 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol

2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol (PubChem CID 114339826) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol
PubChem CID114339826
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC Name2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol
SMILESCc1cccnc1CN1CCCCC1C1CCCCC1O
InChIInChI=1S/C18H28N2O/c1-14-7-6-11-19-16(14)13-20-12-5-4-9-17(20)15-8-2-3-10-18(15)21/h6-7,11,15,17-18,21H,2-5,8-10,12-13H2,1H3
InChIKeyDHNMYQGJLQJWLU-UHFFFAOYSA-N
XLogP3.30
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(pyrimidin-2-ylmethyl)pyrrolidin-2-yl]cyclohexan-1-ol
CID 114339630
3-methyl-2-[(2-pyrrolidin-2-ylpyrrolidin-1-yl)methyl]pyridine
CID 112650958
N'-hydroxy-1-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboximidamide
CID 112650471
[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methanol
CID 103897843
ethyl 1-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxylate
CID 112550209
2-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]cyclopentan-1-ol
CID 114339030
3-methyl-2-[[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]methyl]pyridine
CID 110106195
3-methyl-1-[(3-methyl-2-pyridinyl)methyl]piperidine-2-carboxylic acid
CID 107072167
2-[[2-(3-chloropropyl)pyrrolidin-1-yl]methyl]-3-methylpyridine
CID 112651342
2-(1-ethylpiperidin-2-yl)cyclohexan-1-ol
CID 114339807
2-[(3-methyl-2-pyridinyl)methyl]cycloheptan-1-ol
CID 112651216
N-cyclopropyl-N-[[(2R)-1-[(3-methyl-2-pyridinyl)methyl]pyrrolidin-2-yl]methyl]acetamide
CID 129474004

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol?
The IUPAC name of 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol (CID 114339826) is 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol?
The canonical SMILES for 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol is Cc1cccnc1CN1CCCCC1C1CCCCC1O.
What is the InChIKey of 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol?
The InChIKey is DHNMYQGJLQJWLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-14-7-6-11-19-16(14)13-20-12-5-4-9-17(20)15-8-2-3-10-18(15)21/h6-7,11,15,17-18,21H,2-5,8-10,12-13H2,1H3.
What are the key properties of 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol?
2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol has a molecular weight of 288.43 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(3-methyl-2-pyridinyl)methyl]piperidin-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 114339826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).