2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide

C23H21ClN4O3 — CID 24855191

IUPAC2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide
SMILESCOc1cccc(OCC(N)=O)c1-c1nc2ccccn2c1Nc1c(C)cccc1Cl
InChIInChI=1S/C23H21ClN4O3/c1-14-7-5-8-15(24)21(14)27-23-22(26-19-11-3-4-12-28(19)23)20-16(30-2)9-6-10-17(20)31-13-18(25)29/h3-12,27H,13H2,1-2H3,(H2,25,29)
InChIKeyNVITYYHHQOUWKO-UHFFFAOYSA-N
MW436.90 g/mol
LogP4.58
Rot. Bonds7

About 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide

2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide (PubChem CID 24855191) has the molecular formula C23H21ClN4O3 and a molecular weight of 436.90 g/mol. Its IUPAC name is 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide.

Molecular Properties

Compound Name2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide
PubChem CID24855191
Molecular FormulaC23H21ClN4O3
Molecular Weight436.90 g/mol
Exact Mass436.13
IUPAC Name2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide
SMILESCOc1cccc(OCC(N)=O)c1-c1nc2ccccn2c1Nc1c(C)cccc1Cl
InChIInChI=1S/C23H21ClN4O3/c1-14-7-5-8-15(24)21(14)27-23-22(26-19-11-3-4-12-28(19)23)20-16(30-2)9-6-10-17(20)31-13-18(25)29/h3-12,27H,13H2,1-2H3,(H2,25,29)
InChIKeyNVITYYHHQOUWKO-UHFFFAOYSA-N
XLogP4.58
TPSA90.88 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.90
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[3-cyano-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
CID 67350699
2-[2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]-3-[2-(methylamino)ethoxymethyl]phenoxy]acetamide
CID 58387816
2-[5-[2-(dimethylamino)ethoxy]-2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methylphenoxy]acetamide
CID 67350304
2-[2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]-N,N-dimethylacetamide
CID 24854821
2-[2-[3-(2-chloro-6-methylanilino)-5,6-dimethyl-5,6-dihydroimidazo[1,2-a]pyrimidin-2-yl]-3-ethylphenoxy]acetamide
CID 90321155
2-[2-[6-cyano-3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
CID 67351019
2-[2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]-3-[2-(methylamino)ethylamino]phenoxy]acetamide
CID 67350656
2-[2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]-2-methylpropanamide
CID 67350642
3-[2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyridin-2-yl]phenyl]propanamide
CID 58387815
2-[2-[3-(2,6-dimethylanilino)-5-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
CID 24855245
2-[3-(2-amino-2-oxoethoxy)-4-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]-5-ethylphenoxy]acetamide
CID 67349337
2-[2-[3-(2,6-dimethylanilino)imidazo[1,2-a]pyrimidin-2-yl]-3-ethyl-5-methoxyphenoxy]acetamide
CID 25260594

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide?
The IUPAC name of 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide (CID 24855191) is 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide.
What is the SMILES notation for 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide?
The canonical SMILES for 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide is COc1cccc(OCC(N)=O)c1-c1nc2ccccn2c1Nc1c(C)cccc1Cl.
What is the InChIKey of 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide?
The InChIKey is NVITYYHHQOUWKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClN4O3/c1-14-7-5-8-15(24)21(14)27-23-22(26-19-11-3-4-12-28(19)23)20-16(30-2)9-6-10-17(20)31-13-18(25)29/h3-12,27H,13H2,1-2H3,(H2,25,29).
What are the key properties of 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide?
2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide has a molecular weight of 436.90 g/mol, XLogP of 4.58, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-(2-chloro-6-methylanilino)imidazo[1,2-a]pyridin-2-yl]-3-methoxyphenoxy]acetamide is sourced from PubChem (CID 24855191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).