(3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine

C12H12N4S — CID 115284655

IUPAC(3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine
SMILESCn1c(C(N)c2cccs2)nc2cccnc21
InChIInChI=1S/C12H12N4S/c1-16-11-8(4-2-6-14-11)15-12(16)10(13)9-5-3-7-17-9/h2-7,10H,13H2,1H3
InChIKeySGVYMTUVSOYFGF-UHFFFAOYSA-N
MW244.32 g/mol
LogP2.08
Rot. Bonds2

About (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine

(3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine (PubChem CID 115284655) has the molecular formula C12H12N4S and a molecular weight of 244.32 g/mol. Its IUPAC name is (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine.

Molecular Properties

Compound Name(3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine
PubChem CID115284655
Molecular FormulaC12H12N4S
Molecular Weight244.32 g/mol
Exact Mass244.08
IUPAC Name(3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine
SMILESCn1c(C(N)c2cccs2)nc2cccnc21
InChIInChI=1S/C12H12N4S/c1-16-11-8(4-2-6-14-11)15-12(16)10(13)9-5-3-7-17-9/h2-7,10H,13H2,1H3
InChIKeySGVYMTUVSOYFGF-UHFFFAOYSA-N
XLogP2.08
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.32
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-3-(3-methylimidazo[4,5-b]pyridin-2-yl)propan-1-ol
CID 63758327
3-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridin-2-amine
CID 79290150
N-[1-(3-methylimidazo[4,5-b]pyridin-2-yl)ethyl]propan-1-amine
CID 63756250
2,3-dimethyl-3-(3-methylimidazo[4,5-b]pyridin-2-yl)butan-2-amine
CID 65261518
3-[(R)-amino(thiophen-2-yl)methyl]pyridin-2-amine;hydrochloride
CID 171230932
2-methoxy-3-methylimidazo[4,5-b]pyridine
CID 58577407
dithiophen-2-ylmethanamine;hydroiodide
CID 175262247
2-(fluoromethyl)-3-methylimidazo[4,5-b]pyridine
CID 141030581
2-[3-(1-thiophen-2-ylethyl)imidazo[4,5-b]pyridin-2-yl]sulfanylacetic acid
CID 79273840
3-(thiophen-2-ylmethyl)imidazo[4,5-b]pyridin-2-amine
CID 79289173
(5-methyl-4-propan-2-yl-1,2,4-triazol-3-yl)-thiophen-2-ylmethanamine
CID 115285740
2-hydrazinyl-4-methylpyrido[2,3-b]pyrazin-3-one
CID 71786184

Frequently Asked Questions

What is the IUPAC name of (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine?
The IUPAC name of (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine (CID 115284655) is (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine.
What is the SMILES notation for (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine?
The canonical SMILES for (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine is Cn1c(C(N)c2cccs2)nc2cccnc21.
What is the InChIKey of (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine?
The InChIKey is SGVYMTUVSOYFGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4S/c1-16-11-8(4-2-6-14-11)15-12(16)10(13)9-5-3-7-17-9/h2-7,10H,13H2,1H3.
What are the key properties of (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine?
(3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine has a molecular weight of 244.32 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylimidazo[4,5-b]pyridin-2-yl)-thiophen-2-ylmethanamine is sourced from PubChem (CID 115284655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).