3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide

C15H14Cl2N2O — CID 100600054

IUPAC3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide
SMILESO=C(CCc1c(Cl)cccc1Cl)NCc1cccnc1
InChIInChI=1S/C15H14Cl2N2O/c16-13-4-1-5-14(17)12(13)6-7-15(20)19-10-11-3-2-8-18-9-11/h1-5,8-9H,6-7,10H2,(H,19,20)
InChIKeyALUQXPRPLRGPEA-UHFFFAOYSA-N
MW309.20 g/mol
LogP3.64
Rot. Bonds5

About 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide

3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 100600054) has the molecular formula C15H14Cl2N2O and a molecular weight of 309.20 g/mol. Its IUPAC name is 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide
PubChem CID100600054
Molecular FormulaC15H14Cl2N2O
Molecular Weight309.20 g/mol
Exact Mass308.05
IUPAC Name3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide
SMILESO=C(CCc1c(Cl)cccc1Cl)NCc1cccnc1
InChIInChI=1S/C15H14Cl2N2O/c16-13-4-1-5-14(17)12(13)6-7-15(20)19-10-11-3-2-8-18-9-11/h1-5,8-9H,6-7,10H2,(H,19,20)
InChIKeyALUQXPRPLRGPEA-UHFFFAOYSA-N
XLogP3.64
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.20
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-bromophenyl)-N-(pyridin-3-ylmethyl)propanamide
CID 127122248
2-(2,3-dichloroanilino)-N-(pyridin-3-ylmethyl)acetamide
CID 108999597
5-chloro-N-(pyridin-3-ylmethyl)naphthalene-1-carboxamide
CID 2995794
N-[(2,6-dichlorophenyl)methyl]-1-pyridin-3-ylmethanamine chloride
CID 21233303
2-chloro-N-(pyridin-3-ylmethyl)benzamide
CID 669068
3-(N-acetyl-2,3-dichloroanilino)-N-(pyridin-3-ylmethyl)propanamide
CID 113134300
3-[(4-chlorophenyl)methylamino]-N-(pyridin-3-ylmethyl)propanamide
CID 109021790
3-methoxy-N-(pyridin-3-ylmethyl)propanamide
CID 110839174
2,5-dichloro-N-[3-oxo-3-(pyridin-3-ylmethylamino)propyl]benzamide
CID 47076367
2-chloro-6-fluoro-N-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]benzamide
CID 112993068
N'-[(2-chlorophenyl)methyl]-N-(pyridin-3-ylmethyl)oxamide
CID 44998655
N-(2,3-dichlorophenyl)-3-pyridin-3-ylpropanamide
CID 112519927

Frequently Asked Questions

What is the IUPAC name of 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide (CID 100600054) is 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide is O=C(CCc1c(Cl)cccc1Cl)NCc1cccnc1.
What is the InChIKey of 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is ALUQXPRPLRGPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O/c16-13-4-1-5-14(17)12(13)6-7-15(20)19-10-11-3-2-8-18-9-11/h1-5,8-9H,6-7,10H2,(H,19,20).
What are the key properties of 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide?
3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 309.20 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,6-dichlorophenyl)-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 100600054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).