1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine

C16H17N3 — CID 82481285

IUPAC1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine
SMILESCc1nc(C(N)Cc2ccccc2)n2ccccc12
InChIInChI=1S/C16H17N3/c1-12-15-9-5-6-10-19(15)16(18-12)14(17)11-13-7-3-2-4-8-13/h2-10,14H,11,17H2,1H3
InChIKeySUEAUELEUOCGQL-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.89
Rot. Bonds3

About 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine

1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine (PubChem CID 82481285) has the molecular formula C16H17N3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine.

Molecular Properties

Compound Name1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine
PubChem CID82481285
Molecular FormulaC16H17N3
Molecular Weight251.33 g/mol
Exact Mass251.14
IUPAC Name1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine
SMILESCc1nc(C(N)Cc2ccccc2)n2ccccc12
InChIInChI=1S/C16H17N3/c1-12-15-9-5-6-10-19(15)16(18-12)14(17)11-13-7-3-2-4-8-13/h2-10,14H,11,17H2,1H3
InChIKeySUEAUELEUOCGQL-UHFFFAOYSA-N
XLogP2.89
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine?
The IUPAC name of 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine (CID 82481285) is 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine.
What is the SMILES notation for 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine?
The canonical SMILES for 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine is Cc1nc(C(N)Cc2ccccc2)n2ccccc12.
What is the InChIKey of 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine?
The InChIKey is SUEAUELEUOCGQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3/c1-12-15-9-5-6-10-19(15)16(18-12)14(17)11-13-7-3-2-4-8-13/h2-10,14H,11,17H2,1H3.
What are the key properties of 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine?
1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine has a molecular weight of 251.33 g/mol, XLogP of 2.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methylimidazo[1,5-a]pyridin-3-yl)-2-phenylethanamine is sourced from PubChem (CID 82481285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).