3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide

C15H15ClN2O — CID 84581881

IUPAC3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)CCc2ccc(Cl)cc2)cn1
InChIInChI=1S/C15H15ClN2O/c1-11-2-8-14(10-17-11)18-15(19)9-5-12-3-6-13(16)7-4-12/h2-4,6-8,10H,5,9H2,1H3,(H,18,19)
InChIKeyDUGJPBZSELXNCJ-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.61
Rot. Bonds4

About 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide

3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide (PubChem CID 84581881) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide
PubChem CID84581881
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide
SMILESCc1ccc(NC(=O)CCc2ccc(Cl)cc2)cn1
InChIInChI=1S/C15H15ClN2O/c1-11-2-8-14(10-17-11)18-15(19)9-5-12-3-6-13(16)7-4-12/h2-4,6-8,10H,5,9H2,1H3,(H,18,19)
InChIKeyDUGJPBZSELXNCJ-UHFFFAOYSA-N
XLogP3.61
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-chlorophenyl)-N-(6-methylsulfonyl-3-pyridinyl)propanamide
CID 47037109
1-[2-(4-chlorophenyl)ethyl]-3-(6-methyl-3-pyridinyl)urea
CID 108892033
2-(4-chlorophenoxy)-N-(6-methyl-3-pyridinyl)acetamide;ethane
CID 153349413
3-(4-tert-butylphenyl)-N-(4-chlorophenyl)propanamide
CID 19221191
3-(3-methoxyphenyl)-N-(6-methyl-3-pyridinyl)propanamide
CID 112532458
N-(4-bromo-3-methylphenyl)-3-(4-chlorophenyl)propanamide
CID 100588730
3-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]-N-methylpropanamide
CID 54780708
N-[4-(4-chlorophenyl)phenyl]-3-[4-(hydroxymethyl)phenyl]propanamide
CID 68816989
N,3-bis(4-methylphenyl)propanamide
CID 19220434
3-(4-chlorophenyl)-N-[4-[(2-cyanoacetyl)amino]phenyl]propanamide
CID 108922560
3-(4-chlorophenyl)-N-(3,4-dimethoxyphenyl)propanamide
CID 19220838
3-(4-chlorophenyl)-N-(2,4,6-trimethyl-3-pyridinyl)propanamide
CID 78837758

Frequently Asked Questions

What is the IUPAC name of 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide?
The IUPAC name of 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide (CID 84581881) is 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide.
What is the SMILES notation for 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide?
The canonical SMILES for 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide is Cc1ccc(NC(=O)CCc2ccc(Cl)cc2)cn1.
What is the InChIKey of 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide?
The InChIKey is DUGJPBZSELXNCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-11-2-8-14(10-17-11)18-15(19)9-5-12-3-6-13(16)7-4-12/h2-4,6-8,10H,5,9H2,1H3,(H,18,19).
What are the key properties of 3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide?
3-(4-chlorophenyl)-N-(6-methyl-3-pyridinyl)propanamide has a molecular weight of 274.75 g/mol, XLogP of 3.61, 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-(6-methyl-3-pyridinyl)propanamide is sourced from PubChem (CID 84581881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).