N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide

C14H12Cl2N2O — CID 112519927

IUPACN-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide
SMILESO=C(CCc1cccnc1)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H12Cl2N2O/c15-11-4-1-5-12(14(11)16)18-13(19)7-6-10-3-2-8-17-9-10/h1-5,8-9H,6-7H2,(H,18,19)
InChIKeyFHGCAYFCANCRSO-UHFFFAOYSA-N
MW295.17 g/mol
LogP3.96
Rot. Bonds4

About N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide

N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide (PubChem CID 112519927) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide
PubChem CID112519927
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC NameN-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide
SMILESO=C(CCc1cccnc1)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H12Cl2N2O/c15-11-4-1-5-12(14(11)16)18-13(19)7-6-10-3-2-8-17-9-10/h1-5,8-9H,6-7H2,(H,18,19)
InChIKeyFHGCAYFCANCRSO-UHFFFAOYSA-N
XLogP3.96
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-aminophenyl)-N-(2,3-dichlorophenyl)propanamide
CID 28713636
N-(2-cyanophenyl)-3-pyridin-3-ylpropanamide
CID 110864606
2-(2,3-dichloroanilino)-N-(pyridin-3-ylmethyl)acetamide
CID 108999597
3-pyridin-3-yl-N-(2-pyrrolidin-1-ylphenyl)propanamide
CID 30583465
N-methyl-2-(3-pyridin-3-ylpropanoylamino)benzamide
CID 34754830
methyl 2-hydroxy-3-(3-pyridin-3-ylpropanoylamino)benzoate
CID 56784435
N-(4-iodophenyl)-3-pyridin-3-ylpropanamide
CID 9206675
N,N'-bis(2,3-dichlorophenyl)dodecanediamide
CID 3641487
N-(2,6-dimethylphenyl)-2-(3-pyridin-3-ylpropanoylamino)benzamide
CID 46991790
1-(2,3-dichlorophenyl)-3-pyridin-3-ylurea
CID 51062925
N-(3-chloro-2-methylphenyl)-3-pyridin-4-ylpropanamide
CID 110468468
3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 100600054

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide (CID 112519927) is N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide is O=C(CCc1cccnc1)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide?
The InChIKey is FHGCAYFCANCRSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c15-11-4-1-5-12(14(11)16)18-13(19)7-6-10-3-2-8-17-9-10/h1-5,8-9H,6-7H2,(H,18,19).
What are the key properties of N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide?
N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide has a molecular weight of 295.17 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 112519927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).