N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide

C24H23N3O3S — CID 56537352

IUPACN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide
SMILESCOc1ccc(SC(C)C(=O)Nc2cccc(OCc3cn4ccccc4n3)c2)cc1
InChIInChI=1S/C24H23N3O3S/c1-17(31-22-11-9-20(29-2)10-12-22)24(28)26-18-6-5-7-21(14-18)30-16-19-15-27-13-4-3-8-23(27)25-19/h3-15,17H,16H2,1-2H3,(H,26,28)
InChIKeySUAFSTGBMYDPDS-UHFFFAOYSA-N
MW433.53 g/mol
LogP5.04
Rot. Bonds8

About N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide

N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide (PubChem CID 56537352) has the molecular formula C24H23N3O3S and a molecular weight of 433.53 g/mol. Its IUPAC name is N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide.

Molecular Properties

Compound NameN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide
PubChem CID56537352
Molecular FormulaC24H23N3O3S
Molecular Weight433.53 g/mol
Exact Mass433.15
IUPAC NameN-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide
SMILESCOc1ccc(SC(C)C(=O)Nc2cccc(OCc3cn4ccccc4n3)c2)cc1
InChIInChI=1S/C24H23N3O3S/c1-17(31-22-11-9-20(29-2)10-12-22)24(28)26-18-6-5-7-21(14-18)30-16-19-15-27-13-4-3-8-23(27)25-19/h3-15,17H,16H2,1-2H3,(H,26,28)
InChIKeySUAFSTGBMYDPDS-UHFFFAOYSA-N
XLogP5.04
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.53
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2,4-dimethoxybenzamide
CID 56530511
(2S)-N-(3-methoxyphenyl)-2-(4-methoxyphenyl)sulfanylpropanamide
CID 26649421
2-(3-cyanophenoxy)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]propanamide
CID 56537373
4-[ethyl(methyl)amino]-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530641
4-ethyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56530964
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]naphthalene-1-carboxamide
CID 56537813
3-chloro-6-ethoxy-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]pyridine-2-carboxamide
CID 56530800
4-(imidazo[1,2-a]pyridin-2-ylmethoxy)-N-(3-methylsulfanylphenyl)benzamide
CID 40723689
2-(2-amino-2-oxoethyl)sulfanyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]benzamide
CID 56537715
(E)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-3-phenylprop-2-enamide
CID 56530976
(2S,4S)-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-methylpiperidine-4-carboxamide
CID 120636307
3-(2-fluorophenyl)sulfanyl-N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]propanamide
CID 56530513

Frequently Asked Questions

What is the IUPAC name of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide?
The IUPAC name of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide (CID 56537352) is N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide.
What is the SMILES notation for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide?
The canonical SMILES for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide is COc1ccc(SC(C)C(=O)Nc2cccc(OCc3cn4ccccc4n3)c2)cc1.
What is the InChIKey of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide?
The InChIKey is SUAFSTGBMYDPDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O3S/c1-17(31-22-11-9-20(29-2)10-12-22)24(28)26-18-6-5-7-21(14-18)30-16-19-15-27-13-4-3-8-23(27)25-19/h3-15,17H,16H2,1-2H3,(H,26,28).
What are the key properties of N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide?
N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide has a molecular weight of 433.53 g/mol, XLogP of 5.04, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(imidazo[1,2-a]pyridin-2-ylmethoxy)phenyl]-2-(4-methoxyphenyl)sulfanylpropanamide is sourced from PubChem (CID 56537352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).