6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine

C13H21N3O — CID 113286375

IUPAC6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine
SMILESCOc1ccc(N)c(NC2CCCCC2C)n1
InChIInChI=1S/C13H21N3O/c1-9-5-3-4-6-11(9)15-13-10(14)7-8-12(16-13)17-2/h7-9,11H,3-6,14H2,1-2H3,(H,15,16)
InChIKeyWIEGRMDSIUWZQI-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.66
Rot. Bonds3

About 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine

6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine (PubChem CID 113286375) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine
PubChem CID113286375
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine
SMILESCOc1ccc(N)c(NC2CCCCC2C)n1
InChIInChI=1S/C13H21N3O/c1-9-5-3-4-6-11(9)15-13-10(14)7-8-12(16-13)17-2/h7-9,11H,3-6,14H2,1-2H3,(H,15,16)
InChIKeyWIEGRMDSIUWZQI-UHFFFAOYSA-N
XLogP2.66
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-cyclohexyl-6-methoxypyridine-2,3-diamine
CID 115320270
2-N-(3-ethyl-2-methylcyclopentyl)-6-methoxypyridine-2,3-diamine
CID 115320867
2-N-(2-methylcyclopentyl)pyridine-2,3-diamine
CID 63278381
6-methoxy-2-N-(3-tricyclo[3.2.1.02,4]octanyl)pyridine-2,3-diamine
CID 114095356
6-methoxy-2-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)pyridine-2,3-diamine
CID 115320849
4-N-(2-methylcyclohexyl)quinazoline-2,4-diamine
CID 80776922
6-methoxy-2-N-propan-2-ylpyridine-2,3-diamine
CID 115320271
6-methoxy-2-N-methylpyridine-2,3-diamine;hydrochloride
CID 22731600
2-N-(1-ethylpiperidin-3-yl)-6-methoxypyridine-2,3-diamine
CID 113286474
2-cyclohexyl-6-methoxy-N-(2-methylcyclohexyl)pyrimidin-4-amine
CID 82458345
6-methoxy-N-(2-methylcyclohexyl)-2-propan-2-ylpyrimidin-4-amine
CID 82453766
2-[(3-amino-6-methoxy-2-pyridinyl)amino]-2-(hydroxymethyl)propane-1,3-diol
CID 107845624

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine?
The IUPAC name of 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine (CID 113286375) is 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine.
What is the SMILES notation for 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine?
The canonical SMILES for 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine is COc1ccc(N)c(NC2CCCCC2C)n1.
What is the InChIKey of 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine?
The InChIKey is WIEGRMDSIUWZQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-9-5-3-4-6-11(9)15-13-10(14)7-8-12(16-13)17-2/h7-9,11H,3-6,14H2,1-2H3,(H,15,16).
What are the key properties of 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine?
6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine has a molecular weight of 235.33 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(2-methylcyclohexyl)pyridine-2,3-diamine is sourced from PubChem (CID 113286375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).