2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine

C13H22N2O — CID 43721830

IUPAC2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine
SMILESCOc1ncccc1NC(C)CCC(C)C
InChIInChI=1S/C13H22N2O/c1-10(2)7-8-11(3)15-12-6-5-9-14-13(12)16-4/h5-6,9-11,15H,7-8H2,1-4H3
InChIKeyFGAJDFLHZSQMRS-UHFFFAOYSA-N
MW222.33 g/mol
LogP3.33
Rot. Bonds6

About 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine

2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine (PubChem CID 43721830) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine
PubChem CID43721830
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine
SMILESCOc1ncccc1NC(C)CCC(C)C
InChIInChI=1S/C13H22N2O/c1-10(2)7-8-11(3)15-12-6-5-9-14-13(12)16-4/h5-6,9-11,15H,7-8H2,1-4H3
InChIKeyFGAJDFLHZSQMRS-UHFFFAOYSA-N
XLogP3.33
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(4-methylpentan-2-yl)pyridin-3-amine
CID 43721890
2-N-(2-methoxy-3-pyridinyl)propane-1,2-diamine
CID 103388537
2-methoxy-N-[(2R)-1-methoxypropan-2-yl]pyridin-3-amine
CID 92977511
2-methoxy-N-(1-phenylpropan-2-yl)pyridin-3-amine
CID 55148980
N-(1-cyclopropylethyl)-2-methoxypyridin-3-amine
CID 43721910
tert-butyl N-[2-[(2-methoxy-3-pyridinyl)amino]propyl]carbamate
CID 103388538
2-methoxy-N-(1-thiophen-2-ylethyl)pyridin-3-amine
CID 43721891
N-(5-methylhexan-2-yl)-2-pyrazol-1-ylpyridin-3-amine
CID 43736970
2-methoxy-N-(1-phenylbutyl)pyridin-3-amine
CID 43721710
N-hept-6-en-3-yl-2-methoxypyridin-3-amine
CID 115922090
N-butan-2-yl-2-propan-2-yloxypyridin-3-amine
CID 61374234
2-N-(2-ethoxy-3-pyridinyl)propane-1,2-diamine
CID 103388376

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine?
The IUPAC name of 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine (CID 43721830) is 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine.
What is the SMILES notation for 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine?
The canonical SMILES for 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine is COc1ncccc1NC(C)CCC(C)C.
What is the InChIKey of 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine?
The InChIKey is FGAJDFLHZSQMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-10(2)7-8-11(3)15-12-6-5-9-14-13(12)16-4/h5-6,9-11,15H,7-8H2,1-4H3.
What are the key properties of 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine?
2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine has a molecular weight of 222.33 g/mol, XLogP of 3.33, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(5-methylhexan-2-yl)pyridin-3-amine is sourced from PubChem (CID 43721830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).