4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol

C15H24N2O — CID 115239951

IUPAC4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol
SMILESCN(CCc1cccnc1)CC1CCC(O)CC1
InChIInChI=1S/C15H24N2O/c1-17(10-8-13-3-2-9-16-11-13)12-14-4-6-15(18)7-5-14/h2-3,9,11,14-15,18H,4-8,10,12H2,1H3
InChIKeyIIGSVSCYBNGRMX-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.11
Rot. Bonds5

About 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol

4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol (PubChem CID 115239951) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol
PubChem CID115239951
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol
SMILESCN(CCc1cccnc1)CC1CCC(O)CC1
InChIInChI=1S/C15H24N2O/c1-17(10-8-13-3-2-9-16-11-13)12-14-4-6-15(18)7-5-14/h2-3,9,11,14-15,18H,4-8,10,12H2,1H3
InChIKeyIIGSVSCYBNGRMX-UHFFFAOYSA-N
XLogP2.11
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(piperidin-2-ylmethyl)-2-pyridin-3-ylethanamine
CID 106635742
4-[[methyl-[2-(1H-pyrrol-3-yl)ethyl]amino]methyl]cyclohexan-1-ol
CID 115239943
4-[[methyl(pyridin-3-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 54928175
N-(4-hydroxycyclohexyl)-N-methyl-3-pyridin-3-ylpropanamide
CID 115277440
N-(4-hydroxycyclohexyl)-N-methyl-2-pyridin-3-ylacetamide
CID 115277422
4-[methyl(2-pyridin-3-ylethyl)amino]cyclohexan-1-one
CID 79119944
N-methyl-2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)ethanamine
CID 115211208
N-methyl-2-piperidin-4-yl-N-(2-pyridin-3-ylethyl)acetamide
CID 115160701
N-(cyclopropylmethyl)-N-methyl-3-phenylpropan-1-amine
CID 54365066
4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 115239884
(E)-4-[methyl(2-pyridin-3-ylethyl)amino]but-2-enoic acid
CID 115237374
methyl(2-pyridin-3-ylethyl)cyanamide
CID 117043571

Frequently Asked Questions

What is the IUPAC name of 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol (CID 115239951) is 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol is CN(CCc1cccnc1)CC1CCC(O)CC1.
What is the InChIKey of 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is IIGSVSCYBNGRMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-17(10-8-13-3-2-9-16-11-13)12-14-4-6-15(18)7-5-14/h2-3,9,11,14-15,18H,4-8,10,12H2,1H3.
What are the key properties of 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol?
4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 248.37 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl(2-pyridin-3-ylethyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 115239951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).