6-methylsulfanyl-N-propan-2-ylpyridin-3-amine

C9H14N2S — CID 115929480

IUPAC6-methylsulfanyl-N-propan-2-ylpyridin-3-amine
SMILESCSc1ccc(NC(C)C)cn1
InChIInChI=1S/C9H14N2S/c1-7(2)11-8-4-5-9(12-3)10-6-8/h4-7,11H,1-3H3
InChIKeyOGZKXMAGLJTTMP-UHFFFAOYSA-N
MW182.29 g/mol
LogP2.62
Rot. Bonds3

About 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine

6-methylsulfanyl-N-propan-2-ylpyridin-3-amine (PubChem CID 115929480) has the molecular formula C9H14N2S and a molecular weight of 182.29 g/mol. Its IUPAC name is 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine.

Molecular Properties

Compound Name6-methylsulfanyl-N-propan-2-ylpyridin-3-amine
PubChem CID115929480
Molecular FormulaC9H14N2S
Molecular Weight182.29 g/mol
Exact Mass182.09
IUPAC Name6-methylsulfanyl-N-propan-2-ylpyridin-3-amine
SMILESCSc1ccc(NC(C)C)cn1
InChIInChI=1S/C9H14N2S/c1-7(2)11-8-4-5-9(12-3)10-6-8/h4-7,11H,1-3H3
InChIKeyOGZKXMAGLJTTMP-UHFFFAOYSA-N
XLogP2.62
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.29
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(dicyclopropylmethyl)-6-methylsulfanylpyridin-3-amine
CID 115929475
N-(1-ethoxypropan-2-yl)-6-methylsulfanylpyridin-3-amine
CID 115929463
6-methylsulfanyl-N-(1-thiophen-2-ylethyl)pyridin-3-amine
CID 115929489
4-fluoro-N-propan-2-yl(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-amine
CID 169440641
6-ethyl-N-propan-2-ylpyridin-3-amine
CID 178080028
5-(propan-2-ylamino)pyridine-2-carbaldehyde
CID 84651898
2-(4-methylpiperazin-1-yl)-N-(6-methylsulfanyl-3-pyridinyl)propanamide
CID 75371060
6-methylsulfanylpyridin-3-amine
CID 10261179
2-[5-(propan-2-ylamino)-2-pyridinyl]propan-2-ol
CID 155384095
5-(propan-2-ylamino)pyridine-2-carboximidamide
CID 115489626
4-fluoro-N-[5-(propan-2-ylamino)-2-pyridinyl]benzamide
CID 113023565
3,5-dimethyl-N-(6-methylsulfanyl-3-pyridinyl)-1,2-oxazole-4-sulfonamide
CID 71878682

Frequently Asked Questions

What is the IUPAC name of 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine?
The IUPAC name of 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine (CID 115929480) is 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine.
What is the SMILES notation for 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine?
The canonical SMILES for 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine is CSc1ccc(NC(C)C)cn1.
What is the InChIKey of 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine?
The InChIKey is OGZKXMAGLJTTMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2S/c1-7(2)11-8-4-5-9(12-3)10-6-8/h4-7,11H,1-3H3.
What are the key properties of 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine?
6-methylsulfanyl-N-propan-2-ylpyridin-3-amine has a molecular weight of 182.29 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylsulfanyl-N-propan-2-ylpyridin-3-amine is sourced from PubChem (CID 115929480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).