3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide

C17H19ClN2O — CID 78837758

IUPAC3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
SMILESCc1cc(C)c(NC(=O)CCc2ccc(Cl)cc2)c(C)n1
InChIInChI=1S/C17H19ClN2O/c1-11-10-12(2)19-13(3)17(11)20-16(21)9-6-14-4-7-15(18)8-5-14/h4-5,7-8,10H,6,9H2,1-3H3,(H,20,21)
InChIKeyWLBNKDDLUSYTIW-UHFFFAOYSA-N
MW302.81 g/mol
LogP4.23
Rot. Bonds4

About 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide

3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide (PubChem CID 78837758) has the molecular formula C17H19ClN2O and a molecular weight of 302.81 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
PubChem CID78837758
Molecular FormulaC17H19ClN2O
Molecular Weight302.81 g/mol
Exact Mass302.12
IUPAC Name3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
SMILESCc1cc(C)c(NC(=O)CCc2ccc(Cl)cc2)c(C)n1
InChIInChI=1S/C17H19ClN2O/c1-11-10-12(2)19-13(3)17(11)20-16(21)9-6-14-4-7-15(18)8-5-14/h4-5,7-8,10H,6,9H2,1-3H3,(H,20,21)
InChIKeyWLBNKDDLUSYTIW-UHFFFAOYSA-N
XLogP4.23
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.81
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)butanamide
CID 78888932
3-(4-ethylphenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
CID 78859486
4-phenyl-N-(2,4,6-trimethyl-3-pyridinyl)butanamide
CID 78883201
2-(4-butylphenyl)-N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 78859538
3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide
CID 84581881
N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 586045
N-(4-bromo-3-methylphenyl)-3-(4-chlorophenyl)propanamide
CID 100588730
3-(3,4-dichlorophenyl)-N-(2,6-dimethylphenyl)propanamide
CID 100593249
3-(5-phenyl-1,3-oxazol-2-yl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
CID 78837843
3-(4-chlorophenyl)-N-(2-methyl-1,3-benzothiazol-6-yl)propanamide
CID 110443255
3-[3-[(2,4,6-trimethyl-3-pyridinyl)carbamoylamino]phenyl]propanoic acid
CID 122093877
3-(2-methylpropoxy)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
CID 78873454

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide (CID 78837758) is 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide is Cc1cc(C)c(NC(=O)CCc2ccc(Cl)cc2)c(C)n1.
What is the InChIKey of 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide?
The InChIKey is WLBNKDDLUSYTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O/c1-11-10-12(2)19-13(3)17(11)20-16(21)9-6-14-4-7-15(18)8-5-14/h4-5,7-8,10H,6,9H2,1-3H3,(H,20,21).
What are the key properties of 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide?
3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide has a molecular weight of 302.81 g/mol, XLogP of 4.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide is sourced from PubChem (CID 78837758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).