N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine

C12H17N3 — CID 167286407

IUPACN-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine
SMILESCC(C)CNCc1ncn2ccccc12
InChIInChI=1S/C12H17N3/c1-10(2)7-13-8-11-12-5-3-4-6-15(12)9-14-11/h3-6,9-10,13H,7-8H2,1-2H3
InChIKeyJQBZYSUNYSIXPR-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.08
Rot. Bonds4

About N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine

N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine (PubChem CID 167286407) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine
PubChem CID167286407
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC NameN-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine
SMILESCC(C)CNCc1ncn2ccccc12
InChIInChI=1S/C12H17N3/c1-10(2)7-13-8-11-12-5-3-4-6-15(12)9-14-11/h3-6,9-10,13H,7-8H2,1-2H3
InChIKeyJQBZYSUNYSIXPR-UHFFFAOYSA-N
XLogP2.08
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine?
The IUPAC name of N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine (CID 167286407) is N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine.
What is the SMILES notation for N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine?
The canonical SMILES for N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine is CC(C)CNCc1ncn2ccccc12.
What is the InChIKey of N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine?
The InChIKey is JQBZYSUNYSIXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-10(2)7-13-8-11-12-5-3-4-6-15(12)9-14-11/h3-6,9-10,13H,7-8H2,1-2H3.
What are the key properties of N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine?
N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine has a molecular weight of 203.29 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(imidazo[1,5-a]pyridin-1-ylmethyl)-2-methylpropan-1-amine is sourced from PubChem (CID 167286407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).