5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine

C12H10ClN5 — CID 143780495

IUPAC5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine
SMILESCNc1cc(Cl)cnc1-n1cnc2cccnc21
InChIInChI=1S/C12H10ClN5/c1-14-10-5-8(13)6-16-12(10)18-7-17-9-3-2-4-15-11(9)18/h2-7,14H,1H3
InChIKeyLPTWJFHAVRWHED-UHFFFAOYSA-N
MW259.70 g/mol
LogP2.51
Rot. Bonds2

About 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine

5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine (PubChem CID 143780495) has the molecular formula C12H10ClN5 and a molecular weight of 259.70 g/mol. Its IUPAC name is 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine.

Molecular Properties

Compound Name5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine
PubChem CID143780495
Molecular FormulaC12H10ClN5
Molecular Weight259.70 g/mol
Exact Mass259.06
IUPAC Name5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine
SMILESCNc1cc(Cl)cnc1-n1cnc2cccnc21
InChIInChI=1S/C12H10ClN5/c1-14-10-5-8(13)6-16-12(10)18-7-17-9-3-2-4-15-11(9)18/h2-7,14H,1H3
InChIKeyLPTWJFHAVRWHED-UHFFFAOYSA-N
XLogP2.51
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.70
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine?
The IUPAC name of 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine (CID 143780495) is 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine.
What is the SMILES notation for 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine?
The canonical SMILES for 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine is CNc1cc(Cl)cnc1-n1cnc2cccnc21.
What is the InChIKey of 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine?
The InChIKey is LPTWJFHAVRWHED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN5/c1-14-10-5-8(13)6-16-12(10)18-7-17-9-3-2-4-15-11(9)18/h2-7,14H,1H3.
What are the key properties of 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine?
5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine has a molecular weight of 259.70 g/mol, XLogP of 2.51, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-imidazo[4,5-b]pyridin-3-yl-N-methylpyridin-3-amine is sourced from PubChem (CID 143780495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).