6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine

C22H17ClN4 — CID 4276003

IUPAC6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccccc1Nc1c(-c2c[nH]c3ccccc23)nc2ccc(Cl)cn12
InChIInChI=1S/C22H17ClN4/c1-14-6-2-4-8-18(14)25-22-21(26-20-11-10-15(23)13-27(20)22)17-12-24-19-9-5-3-7-16(17)19/h2-13,24-25H,1H3
InChIKeyXVPNIYASXRIOCT-UHFFFAOYSA-N
MW372.86 g/mol
LogP6.19
Rot. Bonds3

About 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine

6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 4276003) has the molecular formula C22H17ClN4 and a molecular weight of 372.86 g/mol. Its IUPAC name is 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID4276003
Molecular FormulaC22H17ClN4
Molecular Weight372.86 g/mol
Exact Mass372.11
IUPAC Name6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccccc1Nc1c(-c2c[nH]c3ccccc23)nc2ccc(Cl)cn12
InChIInChI=1S/C22H17ClN4/c1-14-6-2-4-8-18(14)25-22-21(26-20-11-10-15(23)13-27(20)22)17-12-24-19-9-5-3-7-16(17)19/h2-13,24-25H,1H3
InChIKeyXVPNIYASXRIOCT-UHFFFAOYSA-N
XLogP6.19
TPSA45.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.86
LogP ≤ 56.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine (CID 4276003) is 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine is Cc1ccccc1Nc1c(-c2c[nH]c3ccccc23)nc2ccc(Cl)cn12.
What is the InChIKey of 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is XVPNIYASXRIOCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17ClN4/c1-14-6-2-4-8-18(14)25-22-21(26-20-11-10-15(23)13-27(20)22)17-12-24-19-9-5-3-7-16(17)19/h2-13,24-25H,1H3.
What are the key properties of 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 372.86 g/mol, XLogP of 6.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(1H-indol-3-yl)-N-(2-methylphenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 4276003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).