2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine

C16H24N2OS — CID 63537895

IUPAC2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine
SMILESCC1CCCC(Sc2ccc(N)c(OCC3CC3)n2)C1
InChIInChI=1S/C16H24N2OS/c1-11-3-2-4-13(9-11)20-15-8-7-14(17)16(18-15)19-10-12-5-6-12/h7-8,11-13H,2-6,9-10,17H2,1H3
InChIKeyCOPFMPBJMZNDIK-UHFFFAOYSA-N
MW292.45 g/mol
LogP4.12
Rot. Bonds5

About 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine

2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine (PubChem CID 63537895) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine
PubChem CID63537895
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine
SMILESCC1CCCC(Sc2ccc(N)c(OCC3CC3)n2)C1
InChIInChI=1S/C16H24N2OS/c1-11-3-2-4-13(9-11)20-15-8-7-14(17)16(18-15)19-10-12-5-6-12/h7-8,11-13H,2-6,9-10,17H2,1H3
InChIKeyCOPFMPBJMZNDIK-UHFFFAOYSA-N
XLogP4.12
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine?
The IUPAC name of 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine (CID 63537895) is 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine?
The canonical SMILES for 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine is CC1CCCC(Sc2ccc(N)c(OCC3CC3)n2)C1.
What is the InChIKey of 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine?
The InChIKey is COPFMPBJMZNDIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-11-3-2-4-13(9-11)20-15-8-7-14(17)16(18-15)19-10-12-5-6-12/h7-8,11-13H,2-6,9-10,17H2,1H3.
What are the key properties of 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine?
2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine has a molecular weight of 292.45 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-6-(3-methylcyclohexyl)sulfanylpyridin-3-amine is sourced from PubChem (CID 63537895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).