1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine

C11H16N4 — CID 63268373

IUPAC1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine
SMILESCCC(C)C(N)c1nc2ccncc2[nH]1
InChIInChI=1S/C11H16N4/c1-3-7(2)10(12)11-14-8-4-5-13-6-9(8)15-11/h4-7,10H,3,12H2,1-2H3,(H,14,15)
InChIKeyLUQVGDJHWCXPGW-UHFFFAOYSA-N
MW204.28 g/mol
LogP2.00
Rot. Bonds3

About 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine

1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine (PubChem CID 63268373) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine.

Molecular Properties

Compound Name1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine
PubChem CID63268373
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine
SMILESCCC(C)C(N)c1nc2ccncc2[nH]1
InChIInChI=1S/C11H16N4/c1-3-7(2)10(12)11-14-8-4-5-13-6-9(8)15-11/h4-7,10H,3,12H2,1-2H3,(H,14,15)
InChIKeyLUQVGDJHWCXPGW-UHFFFAOYSA-N
XLogP2.00
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine?
The IUPAC name of 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine (CID 63268373) is 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine.
What is the SMILES notation for 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine?
The canonical SMILES for 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine is CCC(C)C(N)c1nc2ccncc2[nH]1.
What is the InChIKey of 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine?
The InChIKey is LUQVGDJHWCXPGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-3-7(2)10(12)11-14-8-4-5-13-6-9(8)15-11/h4-7,10H,3,12H2,1-2H3,(H,14,15).
What are the key properties of 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine?
1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine has a molecular weight of 204.28 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3H-imidazo[4,5-c]pyridin-2-yl)-2-methylbutan-1-amine is sourced from PubChem (CID 63268373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).