1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine

C10H13N3S — CID 170308354

IUPAC1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine
SMILESCSC(C)n1ccc2c(N)nccc21
InChIInChI=1S/C10H13N3S/c1-7(14-2)13-6-4-8-9(13)3-5-12-10(8)11/h3-7H,1-2H3,(H2,11,12)
InChIKeyRGPOFPFJPPZXGO-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.50
Rot. Bonds2

About 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine

1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine (PubChem CID 170308354) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine.

Molecular Properties

Compound Name1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine
PubChem CID170308354
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC Name1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine
SMILESCSC(C)n1ccc2c(N)nccc21
InChIInChI=1S/C10H13N3S/c1-7(14-2)13-6-4-8-9(13)3-5-12-10(8)11/h3-7H,1-2H3,(H2,11,12)
InChIKeyRGPOFPFJPPZXGO-UHFFFAOYSA-N
XLogP2.50
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-propan-2-yl-2,6-naphthyridin-1-amine
CID 163390323
1-(1-methylsulfanylethyl)imidazo[4,5-c]pyridine
CID 146228308
2-(4-chloropyrrolo[3,2-c]pyridin-1-yl)propanoic acid
CID 86595130
ethane;4-methyl-1-propan-2-ylpyrrolo[2,3-b]pyridine
CID 172576281
1-methylpyrazolo[4,3-c]pyridine-3,4-diamine
CID 144514733
7-propan-2-ylpyrrolo[2,3-d]pyrimidine-2,4-diamine
CID 58811327
4-methylsulfanyl-2-propan-2-ylpyridin-3-amine
CID 155344987
2-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-4-amine
CID 20680867
2,3-di(propan-2-yl)pyridin-4-amine
CID 162512202
ethane;3-methylsulfanylpyridin-2-amine
CID 142810881
1-(1-aminobutyl)imidazo[4,5-c]pyridin-4-amine
CID 166965124
1,2-dimethylimidazo[4,5-c]pyridin-4-amine
CID 20662696

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine?
The IUPAC name of 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine (CID 170308354) is 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine.
What is the SMILES notation for 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine?
The canonical SMILES for 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine is CSC(C)n1ccc2c(N)nccc21.
What is the InChIKey of 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine?
The InChIKey is RGPOFPFJPPZXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-7(14-2)13-6-4-8-9(13)3-5-12-10(8)11/h3-7H,1-2H3,(H2,11,12).
What are the key properties of 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine?
1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine has a molecular weight of 207.30 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylsulfanylethyl)pyrrolo[3,2-c]pyridin-4-amine is sourced from PubChem (CID 170308354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).