N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine

C9H12N4 — CID 83857849

IUPACN-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine
SMILESCNCc1nc2ccncc2n1C
InChIInChI=1S/C9H12N4/c1-10-6-9-12-7-3-4-11-5-8(7)13(9)2/h3-5,10H,6H2,1-2H3
InChIKeyCWPVXPFOQCUULZ-UHFFFAOYSA-N
MW176.22 g/mol
LogP0.69
Rot. Bonds2

About N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine

N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine (PubChem CID 83857849) has the molecular formula C9H12N4 and a molecular weight of 176.22 g/mol. Its IUPAC name is N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine
PubChem CID83857849
Molecular FormulaC9H12N4
Molecular Weight176.22 g/mol
Exact Mass176.11
IUPAC NameN-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine
SMILESCNCc1nc2ccncc2n1C
InChIInChI=1S/C9H12N4/c1-10-6-9-12-7-3-4-11-5-8(7)13(9)2/h3-5,10H,6H2,1-2H3
InChIKeyCWPVXPFOQCUULZ-UHFFFAOYSA-N
XLogP0.69
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine?
The IUPAC name of N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine (CID 83857849) is N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine is CNCc1nc2ccncc2n1C.
What is the InChIKey of N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine?
The InChIKey is CWPVXPFOQCUULZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4/c1-10-6-9-12-7-3-4-11-5-8(7)13(9)2/h3-5,10H,6H2,1-2H3.
What are the key properties of N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine?
N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine has a molecular weight of 176.22 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylimidazo[4,5-c]pyridin-2-yl)methanamine is sourced from PubChem (CID 83857849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).