7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine

C12H13N5S — CID 79288529

IUPAC7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine
SMILESCc1csc(Cn2c(N)nc3c(C)ccnc32)n1
InChIInChI=1S/C12H13N5S/c1-7-3-4-14-11-10(7)16-12(13)17(11)5-9-15-8(2)6-18-9/h3-4,6H,5H2,1-2H3,(H2,13,16)
InChIKeyOTPJSMOORCUFAA-UHFFFAOYSA-N
MW259.34 g/mol
LogP2.14
Rot. Bonds2

About 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine

7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine (PubChem CID 79288529) has the molecular formula C12H13N5S and a molecular weight of 259.34 g/mol. Its IUPAC name is 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine
PubChem CID79288529
Molecular FormulaC12H13N5S
Molecular Weight259.34 g/mol
Exact Mass259.09
IUPAC Name7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine
SMILESCc1csc(Cn2c(N)nc3c(C)ccnc32)n1
InChIInChI=1S/C12H13N5S/c1-7-3-4-14-11-10(7)16-12(13)17(11)5-9-15-8(2)6-18-9/h3-4,6H,5H2,1-2H3,(H2,13,16)
InChIKeyOTPJSMOORCUFAA-UHFFFAOYSA-N
XLogP2.14
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.34
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine (CID 79288529) is 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine is Cc1csc(Cn2c(N)nc3c(C)ccnc32)n1.
What is the InChIKey of 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine?
The InChIKey is OTPJSMOORCUFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5S/c1-7-3-4-14-11-10(7)16-12(13)17(11)5-9-15-8(2)6-18-9/h3-4,6H,5H2,1-2H3,(H2,13,16).
What are the key properties of 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine?
7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine has a molecular weight of 259.34 g/mol, XLogP of 2.14, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-3-[(4-methyl-1,3-thiazol-2-yl)methyl]imidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 79288529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).