[1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol

C15H24N2O2 — CID 114938871

IUPAC[1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol
SMILESCOc1ccc(C(O)C2(CN)CCC(C)CC2)cn1
InChIInChI=1S/C15H24N2O2/c1-11-5-7-15(10-16,8-6-11)14(18)12-3-4-13(19-2)17-9-12/h3-4,9,11,14,18H,5-8,10,16H2,1-2H3
InChIKeyWQKXYBLGMMCNGK-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.28
Rot. Bonds4

About [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol

[1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol (PubChem CID 114938871) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol.

Molecular Properties

Compound Name[1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol
PubChem CID114938871
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name[1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol
SMILESCOc1ccc(C(O)C2(CN)CCC(C)CC2)cn1
InChIInChI=1S/C15H24N2O2/c1-11-5-7-15(10-16,8-6-11)14(18)12-3-4-13(19-2)17-9-12/h3-4,9,11,14,18H,5-8,10,16H2,1-2H3
InChIKeyWQKXYBLGMMCNGK-UHFFFAOYSA-N
XLogP2.28
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(aminomethyl)-4-methylcyclohexyl]-(3,5-dimethoxyphenyl)methanol
CID 79123901
[1-(aminomethyl)-4-methylcyclohexyl]-(4-tert-butylphenyl)methanol
CID 79126348
[1-(aminomethyl)-4-methylcyclohexyl]-(3-bromophenyl)methanol
CID 79136010
[1-(aminomethyl)-4-methylcyclohexyl]-(3-chlorophenyl)methanol
CID 79138876
[4-(aminomethyl)oxan-4-yl]-(6-methyl-3-pyridinyl)methanol
CID 104824016
(1-methoxy-4-methylcyclohexyl)-(6-methyl-3-pyridinyl)methanol
CID 116754442
[1-(aminomethyl)-3-methylcyclopentyl]-(3,4-dimethylphenyl)methanol
CID 79138726
2-amino-1-(6-methoxy-3-pyridinyl)butan-1-ol
CID 114937489
[1-(aminomethyl)-4-methylcyclohexyl]-(furan-2-yl)methanol
CID 79135081
[1-(aminomethyl)-4-methylcyclohexyl]-(2,6-difluorophenyl)methanol
CID 79137858
(6-methoxy-3-pyridinyl)-(6-oxaspiro[4.5]decan-9-yl)methanol
CID 114938024
bis(6-methoxy-3-pyridinyl)methanol;ethane
CID 145185177

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol?
The IUPAC name of [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol (CID 114938871) is [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol.
What is the SMILES notation for [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol?
The canonical SMILES for [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol is COc1ccc(C(O)C2(CN)CCC(C)CC2)cn1.
What is the InChIKey of [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol?
The InChIKey is WQKXYBLGMMCNGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11-5-7-15(10-16,8-6-11)14(18)12-3-4-13(19-2)17-9-12/h3-4,9,11,14,18H,5-8,10,16H2,1-2H3.
What are the key properties of [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol?
[1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol has a molecular weight of 264.37 g/mol, XLogP of 2.28, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)-4-methylcyclohexyl]-(6-methoxy-3-pyridinyl)methanol is sourced from PubChem (CID 114938871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).