2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine

C16H27N3O — CID 64733639

IUPAC2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine
SMILESCC1CC(C)CC(Nc2ccc(N)c(OC(C)C)n2)C1
InChIInChI=1S/C16H27N3O/c1-10(2)20-16-14(17)5-6-15(19-16)18-13-8-11(3)7-12(4)9-13/h5-6,10-13H,7-9,17H2,1-4H3,(H,18,19)
InChIKeyJFNOJYDRIJUBLY-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.69
Rot. Bonds4

About 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine

2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine (PubChem CID 64733639) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine
PubChem CID64733639
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine
SMILESCC1CC(C)CC(Nc2ccc(N)c(OC(C)C)n2)C1
InChIInChI=1S/C16H27N3O/c1-10(2)20-16-14(17)5-6-15(19-16)18-13-8-11(3)7-12(4)9-13/h5-6,10-13H,7-9,17H2,1-4H3,(H,18,19)
InChIKeyJFNOJYDRIJUBLY-UHFFFAOYSA-N
XLogP3.69
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(3,4-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 64741880
4-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]cyclohexan-1-ol
CID 43260966
2-N-(oxan-3-yl)-6-propan-2-yloxypyridine-2,5-diamine
CID 63359972
2-N-(3-methylbutan-2-yl)-6-propan-2-yloxypyridine-2,5-diamine
CID 43261264
2-N-(3-methylcyclopentyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 114543221
2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-N-cyclopropylacetamide
CID 43568215
2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-3-methylbutan-1-ol
CID 79248203
6-(3-methylcyclohexyl)oxy-2-propan-2-yloxypyridin-3-amine
CID 43262530
2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-3-methoxypropan-1-ol
CID 106184001
2-N-[(1-methylcyclobutyl)methyl]-6-propan-2-yloxypyridine-2,5-diamine
CID 114107323
2-N-(3,5-dimethylphenyl)-6-propan-2-yloxypyridine-2,5-diamine
CID 43261617
N-(3-methylcyclobutyl)-4-propan-2-yloxyaniline
CID 104860033

Frequently Asked Questions

What is the IUPAC name of 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine?
The IUPAC name of 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine (CID 64733639) is 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine.
What is the SMILES notation for 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine?
The canonical SMILES for 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine is CC1CC(C)CC(Nc2ccc(N)c(OC(C)C)n2)C1.
What is the InChIKey of 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine?
The InChIKey is JFNOJYDRIJUBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-10(2)20-16-14(17)5-6-15(19-16)18-13-8-11(3)7-12(4)9-13/h5-6,10-13H,7-9,17H2,1-4H3,(H,18,19).
What are the key properties of 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine?
2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine has a molecular weight of 277.41 g/mol, XLogP of 3.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3,5-dimethylcyclohexyl)-6-propan-2-yloxypyridine-2,5-diamine is sourced from PubChem (CID 64733639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).