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

C14H22N2O — CID 115239884

IUPAC4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol
SMILESCN(Cc1ccccn1)CC1CCC(O)CC1
InChIInChI=1S/C14H22N2O/c1-16(11-13-4-2-3-9-15-13)10-12-5-7-14(17)8-6-12/h2-4,9,12,14,17H,5-8,10-11H2,1H3
InChIKeyBFEXMTPMQYGRIJ-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.06
Rot. Bonds4

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

4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol (PubChem CID 115239884) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol
PubChem CID115239884
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol
SMILESCN(Cc1ccccn1)CC1CCC(O)CC1
InChIInChI=1S/C14H22N2O/c1-16(11-13-4-2-3-9-15-13)10-12-5-7-14(17)8-6-12/h2-4,9,12,14,17H,5-8,10-11H2,1H3
InChIKeyBFEXMTPMQYGRIJ-UHFFFAOYSA-N
XLogP2.06
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(oxiran-2-yl)-N-(pyridin-2-ylmethyl)methanamine
CID 43564926
N-methyl-N-(pyridin-2-ylmethyl)-1-[(3R)-pyrrolidin-3-yl]methanamine
CID 94408610
N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
CID 174963433
4-[[methyl(quinolin-4-ylmethyl)amino]methyl]cyclohexan-1-ol
CID 28642233
ethane;N-methyl-1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine
CID 145471467
2,2,5,5-tetramethyl-4-[[methyl(pyridin-2-ylmethyl)amino]methyl]oxolan-3-ol
CID 79930097
2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclopentan-1-one
CID 62612535
2-(1,3-dioxan-2-yl)-N-methyl-N-(pyridin-2-ylmethyl)ethanamine
CID 66475134
N,4-dimethyl-2-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-amine
CID 62616448
2-[[cyclopentylmethyl(methyl)amino]methyl]pyridin-4-amine
CID 79251445
1-cyclohexyl-2-[methyl(pyridin-2-ylmethyl)amino]ethanone
CID 104750407
2-methyl-1-[methyl(pyridin-2-ylmethyl)amino]propane-2-thiol
CID 91261751

Frequently Asked Questions

What is the IUPAC name of 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol (CID 115239884) is 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol is CN(Cc1ccccn1)CC1CCC(O)CC1.
What is the InChIKey of 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
The InChIKey is BFEXMTPMQYGRIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-16(11-13-4-2-3-9-15-13)10-12-5-7-14(17)8-6-12/h2-4,9,12,14,17H,5-8,10-11H2,1H3.
What are the key properties of 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol?
4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl(pyridin-2-ylmethyl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 115239884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).