3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide

C19H19ClN4O — CID 169305406

IUPAC3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide
SMILESCN(C(=O)CCc1ccc(Cl)cc1)c1ncc(-c2ccncc2)n1C
InChIInChI=1S/C19H19ClN4O/c1-23-17(15-9-11-21-12-10-15)13-22-19(23)24(2)18(25)8-5-14-3-6-16(20)7-4-14/h3-4,6-7,9-13H,5,8H2,1-2H3
InChIKeyVXUASWCRRCMCDR-UHFFFAOYSA-N
MW354.84 g/mol
LogP3.73
Rot. Bonds5

About 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide

3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide (PubChem CID 169305406) has the molecular formula C19H19ClN4O and a molecular weight of 354.84 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide
PubChem CID169305406
Molecular FormulaC19H19ClN4O
Molecular Weight354.84 g/mol
Exact Mass354.12
IUPAC Name3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide
SMILESCN(C(=O)CCc1ccc(Cl)cc1)c1ncc(-c2ccncc2)n1C
InChIInChI=1S/C19H19ClN4O/c1-23-17(15-9-11-21-12-10-15)13-22-19(23)24(2)18(25)8-5-14-3-6-16(20)7-4-14/h3-4,6-7,9-13H,5,8H2,1-2H3
InChIKeyVXUASWCRRCMCDR-UHFFFAOYSA-N
XLogP3.73
TPSA51.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.84
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-chlorophenyl)-N-methyl-N-(4-methyl-5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide
CID 169305452
3-(4-chlorophenyl)-N-[(4-chlorophenyl)methyl]-N-methylpropanamide
CID 100590851
2-(4-chlorophenyl)-N-methyl-N-(2-pyridin-4-ylethyl)acetamide
CID 110755605
N-[3-(4-chlorophenyl)propanoyl]-2-methyl-N-(4-methyl-5-pyridin-4-yl-1H-pyrazol-3-yl)propanamide
CID 169305418
3-[4-[1-[(4-chlorophenyl)methyl]-6-oxo-3-pyridinyl]phenyl]-N,N-dimethylpropanamide
CID 69438815
3-(4-chlorophenyl)-N-[(2-pyridin-4-yl-1,3-thiazol-4-yl)methyl]propanamide
CID 108749175
2-[5-(4-chlorophenyl)-1-methylimidazol-2-yl]sulfanyl-N-[(4-methylphenyl)methyl]acetamide
CID 18569168
N,N-diethyl-3-pyridin-4-ylpropanamide
CID 78878654
N-methyl-3-phenyl-N-(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)propanamide
CID 166581426
3-[3-(4-chlorophenyl)propanoylamino]-N,N-dimethyl-5-pyridin-4-yl-1H-pyrazole-4-carboxamide
CID 166581204
1-[(4-chlorophenyl)methyl]-3-[(1-methyl-5-pyridin-4-ylpyrazol-3-yl)methyl]urea
CID 90555219
3-(4-chlorophenyl)-N-isoquinolin-5-ylpropanamide
CID 29372808

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide (CID 169305406) is 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide is CN(C(=O)CCc1ccc(Cl)cc1)c1ncc(-c2ccncc2)n1C.
What is the InChIKey of 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide?
The InChIKey is VXUASWCRRCMCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN4O/c1-23-17(15-9-11-21-12-10-15)13-22-19(23)24(2)18(25)8-5-14-3-6-16(20)7-4-14/h3-4,6-7,9-13H,5,8H2,1-2H3.
What are the key properties of 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide?
3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide has a molecular weight of 354.84 g/mol, XLogP of 3.73, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-methyl-N-(1-methyl-5-pyridin-4-ylimidazol-2-yl)propanamide is sourced from PubChem (CID 169305406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).