1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine

C12H16ClN3 — CID 83869364

IUPAC1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine
SMILESCCc1nc(CC(C)N)c2c(Cl)cccn12
InChIInChI=1S/C12H16ClN3/c1-3-11-15-10(7-8(2)14)12-9(13)5-4-6-16(11)12/h4-6,8H,3,7,14H2,1-2H3
InChIKeyNECYXENWPKQZOK-UHFFFAOYSA-N
MW237.73 g/mol
LogP2.44
Rot. Bonds3

About 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine

1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine (PubChem CID 83869364) has the molecular formula C12H16ClN3 and a molecular weight of 237.73 g/mol. Its IUPAC name is 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine
PubChem CID83869364
Molecular FormulaC12H16ClN3
Molecular Weight237.73 g/mol
Exact Mass237.10
IUPAC Name1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine
SMILESCCc1nc(CC(C)N)c2c(Cl)cccn12
InChIInChI=1S/C12H16ClN3/c1-3-11-15-10(7-8(2)14)12-9(13)5-4-6-16(11)12/h4-6,8H,3,7,14H2,1-2H3
InChIKeyNECYXENWPKQZOK-UHFFFAOYSA-N
XLogP2.44
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.73
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine?
The IUPAC name of 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine (CID 83869364) is 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine.
What is the SMILES notation for 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine?
The canonical SMILES for 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine is CCc1nc(CC(C)N)c2c(Cl)cccn12.
What is the InChIKey of 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine?
The InChIKey is NECYXENWPKQZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClN3/c1-3-11-15-10(7-8(2)14)12-9(13)5-4-6-16(11)12/h4-6,8H,3,7,14H2,1-2H3.
What are the key properties of 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine?
1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine has a molecular weight of 237.73 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-chloro-3-ethylimidazo[1,5-a]pyridin-1-yl)propan-2-amine is sourced from PubChem (CID 83869364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).