1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol

C12H18N2O2 — CID 106873633

IUPAC1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol
SMILESCOC1CCCCC1(O)c1cnccc1N
InChIInChI=1S/C12H18N2O2/c1-16-11-4-2-3-6-12(11,15)9-8-14-7-5-10(9)13/h5,7-8,11,15H,2-4,6H2,1H3,(H2,13,14)
InChIKeyHAASFMQYJUSYKV-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.44
Rot. Bonds2

About 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol

1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol (PubChem CID 106873633) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol.

Molecular Properties

Compound Name1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol
PubChem CID106873633
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol
SMILESCOC1CCCCC1(O)c1cnccc1N
InChIInChI=1S/C12H18N2O2/c1-16-11-4-2-3-6-12(11,15)9-8-14-7-5-10(9)13/h5,7-8,11,15H,2-4,6H2,1H3,(H2,13,14)
InChIKeyHAASFMQYJUSYKV-UHFFFAOYSA-N
XLogP1.44
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-isoquinolin-4-yl-2-methoxycyclohexan-1-ol
CID 106873556
1-(2-amino-5-chloro-3-pyridinyl)-2-methoxycyclohexan-1-ol
CID 106873494
2-methoxy-1-(2-methoxyphenyl)cyclohexan-1-ol
CID 106873696
1-(4-amino-3-pyridinyl)-2,4,4-trimethylcyclohexan-1-ol
CID 81314198
3-(2-propan-2-ylpyrrolidin-2-yl)pyridin-4-amine
CID 66467880
2-methoxy-1-[2-(trifluoromethyl)phenyl]cyclohexan-1-ol
CID 106873665
2-methoxy-1-[2-methyl-4-(trifluoromethyl)phenyl]cyclohexan-1-ol
CID 106873545
2-methoxy-1-(3-methyltriazol-4-yl)cyclohexan-1-ol
CID 106873715
cis-(1R,2S)-2-methoxy-1-quinolin-3-ylcyclohexan-1-ol
CID 67826676
2-methoxy-1-[2-(2-methoxyethoxy)phenyl]cyclohexan-1-ol
CID 106873761
1-(furan-3-yl)-2-methoxycyclohexan-1-ol
CID 106873777
3-(2-cyclopropylpyrrolidin-2-yl)pyridin-4-amine
CID 66467867

Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol?
The IUPAC name of 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol (CID 106873633) is 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol.
What is the SMILES notation for 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol?
The canonical SMILES for 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol is COC1CCCCC1(O)c1cnccc1N.
What is the InChIKey of 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol?
The InChIKey is HAASFMQYJUSYKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-16-11-4-2-3-6-12(11,15)9-8-14-7-5-10(9)13/h5,7-8,11,15H,2-4,6H2,1H3,(H2,13,14).
What are the key properties of 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol?
1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol has a molecular weight of 222.29 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-3-pyridinyl)-2-methoxycyclohexan-1-ol is sourced from PubChem (CID 106873633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).