3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide

C26H25ClN4O4 — CID 55949718

IUPAC3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide
SMILESCOc1ccc(NC(=O)CC(NC(C)=O)c2ccc(Cl)cc2)cc1OCc1cn2ccccc2n1
InChIInChI=1S/C26H25ClN4O4/c1-17(32)28-22(18-6-8-19(27)9-7-18)14-26(33)30-20-10-11-23(34-2)24(13-20)35-16-21-15-31-12-4-3-5-25(31)29-21/h3-13,15,22H,14,16H2,1-2H3,(H,28,32)(H,30,33)
InChIKeyGHAFIBOSKZFQMT-UHFFFAOYSA-N
MW492.96 g/mol
LogP4.78
Rot. Bonds9

About 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide

3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide (PubChem CID 55949718) has the molecular formula C26H25ClN4O4 and a molecular weight of 492.96 g/mol. Its IUPAC name is 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide.

Molecular Properties

Compound Name3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide
PubChem CID55949718
Molecular FormulaC26H25ClN4O4
Molecular Weight492.96 g/mol
Exact Mass492.16
IUPAC Name3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide
SMILESCOc1ccc(NC(=O)CC(NC(C)=O)c2ccc(Cl)cc2)cc1OCc1cn2ccccc2n1
InChIInChI=1S/C26H25ClN4O4/c1-17(32)28-22(18-6-8-19(27)9-7-18)14-26(33)30-20-10-11-23(34-2)24(13-20)35-16-21-15-31-12-4-3-5-25(31)29-21/h3-13,15,22H,14,16H2,1-2H3,(H,28,32)(H,30,33)
InChIKeyGHAFIBOSKZFQMT-UHFFFAOYSA-N
XLogP4.78
TPSA93.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500492.96
LogP ≤ 54.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-amino-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-2-methylpropanamide
CID 119859743
3-(furan-2-yl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide
CID 55826214
4-(difluoromethylsulfanyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]benzamide
CID 52668432
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-2-pyrrolidin-2-ylacetamide
CID 119859777
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119859782
4-(difluoromethylsulfonyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]benzamide
CID 55950861
3-acetamido-3-(4-chlorophenyl)-N-(4-methoxyphenyl)propanamide
CID 46689011
3-amino-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]cyclopentane-1-carboxamide
CID 119859749
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-5-methyl-1-benzofuran-2-carboxamide
CID 55949341
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 55949079
N-[2-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyanilino]-2-oxoethyl]-4-oxo-1H-quinoline-3-carboxamide
CID 55949083
5-chloro-2-(imidazo[1,2-a]pyridin-2-ylmethoxy)benzamide
CID 17469223

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide?
The IUPAC name of 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide (CID 55949718) is 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide.
What is the SMILES notation for 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide?
The canonical SMILES for 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide is COc1ccc(NC(=O)CC(NC(C)=O)c2ccc(Cl)cc2)cc1OCc1cn2ccccc2n1.
What is the InChIKey of 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide?
The InChIKey is GHAFIBOSKZFQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25ClN4O4/c1-17(32)28-22(18-6-8-19(27)9-7-18)14-26(33)30-20-10-11-23(34-2)24(13-20)35-16-21-15-31-12-4-3-5-25(31)29-21/h3-13,15,22H,14,16H2,1-2H3,(H,28,32)(H,30,33).
What are the key properties of 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide?
3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide has a molecular weight of 492.96 g/mol, XLogP of 4.78, 9 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-3-(4-chlorophenyl)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)-4-methoxyphenyl]propanamide is sourced from PubChem (CID 55949718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).