2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine

C15H27N3O — CID 103460190

IUPAC2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
SMILESCCC(C)(C)CNc1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C15H27N3O/c1-7-15(5,6)10-17-12-9-8-11(16)13(18-12)19-14(2,3)4/h8-9H,7,10,16H2,1-6H3,(H,17,18)
InChIKeyTVBULXPWCDDBEH-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.69
Rot. Bonds5

About 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine

2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine (PubChem CID 103460190) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
PubChem CID103460190
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
SMILESCCC(C)(C)CNc1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C15H27N3O/c1-7-15(5,6)10-17-12-9-8-11(16)13(18-12)19-14(2,3)4/h8-9H,7,10,16H2,1-6H3,(H,17,18)
InChIKeyTVBULXPWCDDBEH-UHFFFAOYSA-N
XLogP3.69
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-3,3-dimethylbutan-1-ol
CID 106140773
2-N-ethyl-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 43260941
5-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-4,4-dimethylpentan-1-ol
CID 106141303
6-[(2-methylpropan-2-yl)oxy]-2-N-(2,2,3,3-tetrafluoropropyl)pyridine-2,5-diamine
CID 106289927
3-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-2,2-difluoropropan-1-ol
CID 106167469
6-[(2-methylpropan-2-yl)oxy]-2-N-prop-2-enylpyridine-2,5-diamine
CID 62500488
6-[(2-methylpropan-2-yl)oxy]-2-N-(2-methylsulfanylethyl)pyridine-2,5-diamine
CID 63982043
2-N-(3-methoxypropyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 43261799
2-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-N-methylacetamide
CID 43310372
2-N-(3-ethylpentan-2-yl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 63842748
6-[(2-methylpropan-2-yl)oxy]-2-N-(2-pyrazol-1-ylethyl)pyridine-2,5-diamine
CID 61460018
2-N-(3-cyclopentylpropyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine
CID 106007172

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine?
The IUPAC name of 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine (CID 103460190) is 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine.
What is the SMILES notation for 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine?
The canonical SMILES for 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine is CCC(C)(C)CNc1ccc(N)c(OC(C)(C)C)n1.
What is the InChIKey of 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine?
The InChIKey is TVBULXPWCDDBEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-7-15(5,6)10-17-12-9-8-11(16)13(18-12)19-14(2,3)4/h8-9H,7,10,16H2,1-6H3,(H,17,18).
What are the key properties of 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine?
2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine has a molecular weight of 265.40 g/mol, XLogP of 3.69, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,2-dimethylbutyl)-6-[(2-methylpropan-2-yl)oxy]pyridine-2,5-diamine is sourced from PubChem (CID 103460190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).