N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide

C22H26N4O4S — CID 55976044

IUPACN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
SMILESCc1ccn2cc(CNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)nc2c1
InChIInChI=1S/C22H26N4O4S/c1-17-8-9-25-16-19(24-21(25)14-17)15-23-22(27)7-4-18-2-5-20(6-3-18)31(28,29)26-10-12-30-13-11-26/h2-3,5-6,8-9,14,16H,4,7,10-13,15H2,1H3,(H,23,27)
InChIKeyZVYWPPFLIPJRAL-UHFFFAOYSA-N
MW442.54 g/mol
LogP1.91
Rot. Bonds7

About N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide

N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide (PubChem CID 55976044) has the molecular formula C22H26N4O4S and a molecular weight of 442.54 g/mol. Its IUPAC name is N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide.

Molecular Properties

Compound NameN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
PubChem CID55976044
Molecular FormulaC22H26N4O4S
Molecular Weight442.54 g/mol
Exact Mass442.17
IUPAC NameN-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
SMILESCc1ccn2cc(CNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)nc2c1
InChIInChI=1S/C22H26N4O4S/c1-17-8-9-25-16-19(24-21(25)14-17)15-23-22(27)7-4-18-2-5-20(6-3-18)31(28,29)26-10-12-30-13-11-26/h2-3,5-6,8-9,14,16H,4,7,10-13,15H2,1H3,(H,23,27)
InChIKeyZVYWPPFLIPJRAL-UHFFFAOYSA-N
XLogP1.91
TPSA93.01 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.54
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(4-morpholin-4-ylsulfonylphenyl)-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]propanamide
CID 43875203
N-(imidazo[1,2-a]pyridin-2-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 17470745
3-(4-methylphenyl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 19061853
N-(2-hydroxy-4-methylphenyl)-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 2103502
3-(4-morpholin-4-ylsulfonylphenyl)-N-[(2,4,6-trimethoxyphenyl)methyl]propanamide
CID 55806613
N-[(3-methoxyphenyl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 27231712
3-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]propanamide
CID 27862054
N-[4-methyl-5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 55895813
N-[3-(4-methoxyphenyl)propyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 55921189
3-(4-morpholin-4-ylsulfonylphenyl)-N-[[4-(1H-pyrazol-5-yl)phenyl]methyl]propanamide
CID 55839411
N-[[1-(3-methylphenyl)cyclohexyl]methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 55802503
N-[(4-morpholin-4-ylsulfonylphenyl)methyl]-4-phenylbutanamide
CID 55704601

Frequently Asked Questions

What is the IUPAC name of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The IUPAC name of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide (CID 55976044) is N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide.
What is the SMILES notation for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The canonical SMILES for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide is Cc1ccn2cc(CNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)nc2c1.
What is the InChIKey of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide?
The InChIKey is ZVYWPPFLIPJRAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N4O4S/c1-17-8-9-25-16-19(24-21(25)14-17)15-23-22(27)7-4-18-2-5-20(6-3-18)31(28,29)26-10-12-30-13-11-26/h2-3,5-6,8-9,14,16H,4,7,10-13,15H2,1H3,(H,23,27).
What are the key properties of N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide?
N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide has a molecular weight of 442.54 g/mol, XLogP of 1.91, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide is sourced from PubChem (CID 55976044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).