1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine

C14H19ClN4 — CID 117252254

IUPAC1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
SMILESCCN1CCC(c2nc(Cl)c3c(N)cccn23)CC1
InChIInChI=1S/C14H19ClN4/c1-2-18-8-5-10(6-9-18)14-17-13(15)12-11(16)4-3-7-19(12)14/h3-4,7,10H,2,5-6,8-9,16H2,1H3
InChIKeyUPYBMBPMZWKDKW-UHFFFAOYSA-N
MW278.79 g/mol
LogP2.77
Rot. Bonds2

About 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine

1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine (PubChem CID 117252254) has the molecular formula C14H19ClN4 and a molecular weight of 278.79 g/mol. Its IUPAC name is 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
PubChem CID117252254
Molecular FormulaC14H19ClN4
Molecular Weight278.79 g/mol
Exact Mass278.13
IUPAC Name1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine
SMILESCCN1CCC(c2nc(Cl)c3c(N)cccn23)CC1
InChIInChI=1S/C14H19ClN4/c1-2-18-8-5-10(6-9-18)14-17-13(15)12-11(16)4-3-7-19(12)14/h3-4,7,10H,2,5-6,8-9,16H2,1H3
InChIKeyUPYBMBPMZWKDKW-UHFFFAOYSA-N
XLogP2.77
TPSA46.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.79
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine?
The IUPAC name of 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine (CID 117252254) is 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine?
The canonical SMILES for 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine is CCN1CCC(c2nc(Cl)c3c(N)cccn23)CC1.
What is the InChIKey of 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine?
The InChIKey is UPYBMBPMZWKDKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN4/c1-2-18-8-5-10(6-9-18)14-17-13(15)12-11(16)4-3-7-19(12)14/h3-4,7,10H,2,5-6,8-9,16H2,1H3.
What are the key properties of 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine?
1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine has a molecular weight of 278.79 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-3-(1-ethylpiperidin-4-yl)imidazo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 117252254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).