2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine

C20H18ClN3S — CID 15989643

IUPAC2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1ccn2c(Nc3c(C)cccc3C)c(-c3ccc(Cl)s3)nc2c1
InChIInChI=1S/C20H18ClN3S/c1-12-9-10-24-17(11-12)22-19(15-7-8-16(21)25-15)20(24)23-18-13(2)5-4-6-14(18)3/h4-11,23H,1-3H3
InChIKeyYMFAWWGYDDLJNJ-UHFFFAOYSA-N
MW367.91 g/mol
LogP6.39
Rot. Bonds3

About 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine

2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine (PubChem CID 15989643) has the molecular formula C20H18ClN3S and a molecular weight of 367.91 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
PubChem CID15989643
Molecular FormulaC20H18ClN3S
Molecular Weight367.91 g/mol
Exact Mass367.09
IUPAC Name2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine
SMILESCc1ccn2c(Nc3c(C)cccc3C)c(-c3ccc(Cl)s3)nc2c1
InChIInChI=1S/C20H18ClN3S/c1-12-9-10-24-17(11-12)22-19(15-7-8-16(21)25-15)20(24)23-18-13(2)5-4-6-14(18)3/h4-11,23H,1-3H3
InChIKeyYMFAWWGYDDLJNJ-UHFFFAOYSA-N
XLogP6.39
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.91
LogP ≤ 56.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine (CID 15989643) is 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine is Cc1ccn2c(Nc3c(C)cccc3C)c(-c3ccc(Cl)s3)nc2c1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is YMFAWWGYDDLJNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3S/c1-12-9-10-24-17(11-12)22-19(15-7-8-16(21)25-15)20(24)23-18-13(2)5-4-6-14(18)3/h4-11,23H,1-3H3.
What are the key properties of 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine?
2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 367.91 g/mol, XLogP of 6.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorothiophen-2-yl)-N-(2,6-dimethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 15989643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).