3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine

C14H12ClN3 — CID 117142070

IUPAC3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine
SMILESNc1cccc2cnc(Cc3ccc(Cl)cc3)n12
InChIInChI=1S/C14H12ClN3/c15-11-6-4-10(5-7-11)8-14-17-9-12-2-1-3-13(16)18(12)14/h1-7,9H,8,16H2
InChIKeyLWGSNIAPMSUPLC-UHFFFAOYSA-N
MW257.72 g/mol
LogP3.16
Rot. Bonds2

About 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine

3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine (PubChem CID 117142070) has the molecular formula C14H12ClN3 and a molecular weight of 257.72 g/mol. Its IUPAC name is 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine.

Molecular Properties

Compound Name3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine
PubChem CID117142070
Molecular FormulaC14H12ClN3
Molecular Weight257.72 g/mol
Exact Mass257.07
IUPAC Name3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine
SMILESNc1cccc2cnc(Cc3ccc(Cl)cc3)n12
InChIInChI=1S/C14H12ClN3/c15-11-6-4-10(5-7-11)8-14-17-9-12-2-1-3-13(16)18(12)14/h1-7,9H,8,16H2
InChIKeyLWGSNIAPMSUPLC-UHFFFAOYSA-N
XLogP3.16
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine?
The IUPAC name of 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine (CID 117142070) is 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine.
What is the SMILES notation for 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine?
The canonical SMILES for 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine is Nc1cccc2cnc(Cc3ccc(Cl)cc3)n12.
What is the InChIKey of 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine?
The InChIKey is LWGSNIAPMSUPLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3/c15-11-6-4-10(5-7-11)8-14-17-9-12-2-1-3-13(16)18(12)14/h1-7,9H,8,16H2.
What are the key properties of 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine?
3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine has a molecular weight of 257.72 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-chlorophenyl)methyl]imidazo[1,5-a]pyridin-5-amine is sourced from PubChem (CID 117142070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).