5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine

C13H20N2O — CID 83917616

IUPAC5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine
SMILESCC(C)c1ncc(C2CCOCC2)cc1N
InChIInChI=1S/C13H20N2O/c1-9(2)13-12(14)7-11(8-15-13)10-3-5-16-6-4-10/h7-10H,3-6,14H2,1-2H3
InChIKeyRDSMSGWQSIEKKJ-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.68
Rot. Bonds2

About 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine

5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine (PubChem CID 83917616) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine.

Molecular Properties

Compound Name5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine
PubChem CID83917616
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine
SMILESCC(C)c1ncc(C2CCOCC2)cc1N
InChIInChI=1S/C13H20N2O/c1-9(2)13-12(14)7-11(8-15-13)10-3-5-16-6-4-10/h7-10H,3-6,14H2,1-2H3
InChIKeyRDSMSGWQSIEKKJ-UHFFFAOYSA-N
XLogP2.68
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(oxan-4-yl)pyrimidin-2-yl]ethanamine
CID 105460761
5-(oxan-4-yl)-3-(trifluoromethyl)pyridin-2-amine
CID 171390475
5-cyclopentyl-2-(2-methylpropyl)pyridin-3-amine
CID 83917440
3-methyl-5-(oxan-4-yl)pyridine-2-carboxylic acid
CID 171365286
2-methylsulfanyl-4-(oxan-4-yl)aniline
CID 134507908
2-[5-(oxan-4-yl)pyrimidin-2-yl]ethanamine
CID 83916591
3-methyl-5-(1-methylpiperidin-4-yl)-2-propan-2-ylpyridine
CID 170588740
5-methoxy-2-(oxan-4-yl)pyridin-4-amine
CID 58962706
5-cyclopentyl-2-propan-2-ylpyridine-3-carboxylic acid
CID 83918791
5-cyclobutyl-2-ethylpyridin-3-amine
CID 83914783
2-(1-chloroethyl)-5-(oxan-4-yl)-1,3-oxazole
CID 65180223
3-fluoro-2-propan-2-yl-5-(1-propan-2-ylpiperidin-4-yl)pyridine
CID 176932011

Frequently Asked Questions

What is the IUPAC name of 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine?
The IUPAC name of 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine (CID 83917616) is 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine.
What is the SMILES notation for 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine?
The canonical SMILES for 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine is CC(C)c1ncc(C2CCOCC2)cc1N.
What is the InChIKey of 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine?
The InChIKey is RDSMSGWQSIEKKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9(2)13-12(14)7-11(8-15-13)10-3-5-16-6-4-10/h7-10H,3-6,14H2,1-2H3.
What are the key properties of 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine?
5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxan-4-yl)-2-propan-2-ylpyridin-3-amine is sourced from PubChem (CID 83917616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).