3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine

C14H21N3 — CID 94231471

IUPAC3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine
SMILESCC(C)Cc1nc(CCCN)c2ccccn12
InChIInChI=1S/C14H21N3/c1-11(2)10-14-16-12(6-5-8-15)13-7-3-4-9-17(13)14/h3-4,7,9,11H,5-6,8,10,15H2,1-2H3
InChIKeyGABZPUJXUPAQKK-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.42
Rot. Bonds5

About 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine

3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine (PubChem CID 94231471) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine.

Molecular Properties

Compound Name3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine
PubChem CID94231471
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC Name3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine
SMILESCC(C)Cc1nc(CCCN)c2ccccn12
InChIInChI=1S/C14H21N3/c1-11(2)10-14-16-12(6-5-8-15)13-7-3-4-9-17(13)14/h3-4,7,9,11H,5-6,8,10,15H2,1-2H3
InChIKeyGABZPUJXUPAQKK-UHFFFAOYSA-N
XLogP2.42
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine?
The IUPAC name of 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine (CID 94231471) is 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine.
What is the SMILES notation for 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine?
The canonical SMILES for 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine is CC(C)Cc1nc(CCCN)c2ccccn12.
What is the InChIKey of 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine?
The InChIKey is GABZPUJXUPAQKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-11(2)10-14-16-12(6-5-8-15)13-7-3-4-9-17(13)14/h3-4,7,9,11H,5-6,8,10,15H2,1-2H3.
What are the key properties of 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine?
3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine has a molecular weight of 231.34 g/mol, XLogP of 2.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-methylpropyl)imidazo[1,5-a]pyridin-1-yl]propan-1-amine is sourced from PubChem (CID 94231471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).