6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine

C21H24ClN3O2 — CID 3488126

IUPAC6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(-c2nc3ccc(Cl)cn3c2NC2CCCCC2)cc1OC
InChIInChI=1S/C21H24ClN3O2/c1-26-17-10-8-14(12-18(17)27-2)20-21(23-16-6-4-3-5-7-16)25-13-15(22)9-11-19(25)24-20/h8-13,16,23H,3-7H2,1-2H3
InChIKeyTYZJHHWDKSMPMQ-UHFFFAOYSA-N
MW385.90 g/mol
LogP5.42
Rot. Bonds5

About 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine

6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 3488126) has the molecular formula C21H24ClN3O2 and a molecular weight of 385.90 g/mol. Its IUPAC name is 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID3488126
Molecular FormulaC21H24ClN3O2
Molecular Weight385.90 g/mol
Exact Mass385.16
IUPAC Name6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCOc1ccc(-c2nc3ccc(Cl)cn3c2NC2CCCCC2)cc1OC
InChIInChI=1S/C21H24ClN3O2/c1-26-17-10-8-14(12-18(17)27-2)20-21(23-16-6-4-3-5-7-16)25-13-15(22)9-11-19(25)24-20/h8-13,16,23H,3-7H2,1-2H3
InChIKeyTYZJHHWDKSMPMQ-UHFFFAOYSA-N
XLogP5.42
TPSA47.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.90
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopentyl-2-(3,4-dimethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-amine
CID 162650595
1-[3-[4-[6-chloro-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxyphenoxy]propyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 71575233
1-[3-[4-[6-chloro-3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxyphenoxy]propyl]-3-[4-(trifluoromethoxy)phenyl]urea
CID 71575136
6-chloro-3-(chloromethyl)-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridine
CID 39133106
[6-chloro-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199396
6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine
CID 1154272
4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxyphenol
CID 861991
5-[3-(cyclopentylamino)-6-phenoxyimidazo[1,2-a]pyridin-2-yl]-2-methoxyphenol
CID 45270106
6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine
CID 808991
[4-[3-(cyclohexylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxyphenyl] 4-chlorobutanoate
CID 42743741
3-[6-chloro-3-(cyclopentylamino)imidazo[1,2-a]pyridin-2-yl]-7-methoxy-1H-quinolin-2-one
CID 1433274
2-[3-(3-chlorophenyl)-4-methoxyphenyl]-N-cyclohexylimidazo[1,2-a]pyrazin-3-amine
CID 42601027

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine (CID 3488126) is 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine is COc1ccc(-c2nc3ccc(Cl)cn3c2NC2CCCCC2)cc1OC.
What is the InChIKey of 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is TYZJHHWDKSMPMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN3O2/c1-26-17-10-8-14(12-18(17)27-2)20-21(23-16-6-4-3-5-7-16)25-13-15(22)9-11-19(25)24-20/h8-13,16,23H,3-7H2,1-2H3.
What are the key properties of 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine?
6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 385.90 g/mol, XLogP of 5.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-cyclohexyl-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 3488126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).