3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide

C19H24N2O — CID 86286437

IUPAC3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide
SMILESCc1ccc(CCC(=O)NC(C)Cc2cccnc2)cc1C
InChIInChI=1S/C19H24N2O/c1-14-6-7-17(11-15(14)2)8-9-19(22)21-16(3)12-18-5-4-10-20-13-18/h4-7,10-11,13,16H,8-9,12H2,1-3H3,(H,21,22)
InChIKeyPVZMRIIMTSREOI-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.38
Rot. Bonds6

About 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide

3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide (PubChem CID 86286437) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide.

Molecular Properties

Compound Name3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide
PubChem CID86286437
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide
SMILESCc1ccc(CCC(=O)NC(C)Cc2cccnc2)cc1C
InChIInChI=1S/C19H24N2O/c1-14-6-7-17(11-15(14)2)8-9-19(22)21-16(3)12-18-5-4-10-20-13-18/h4-7,10-11,13,16H,8-9,12H2,1-3H3,(H,21,22)
InChIKeyPVZMRIIMTSREOI-UHFFFAOYSA-N
XLogP3.38
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1H-pyrazol-4-yl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide
CID 131916256
3-(3,4-dimethylphenyl)-N-(3-pyridin-3-ylpropyl)propanamide
CID 91761122
4-chloro-N-(1-pyridin-3-ylpropan-2-yl)butanamide
CID 82110099
3-(3-chloro-4-methylphenyl)-N-(1-pyridin-3-ylethyl)propanamide
CID 24642247
3-(3-chloro-4-methylphenyl)-N-[(1R)-1-pyridin-3-ylethyl]propanamide
CID 30537602
2-(3-chloro-4-hydroxyphenyl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]acetamide
CID 99973874
N-(1-imidazol-1-ylpropan-2-yl)-3-pyridin-3-ylpropanamide
CID 55683150
N-[1-(3-methylphenoxy)propan-2-yl]-3-pyridin-3-ylpropanamide
CID 86828425
2-(1,3-benzodioxol-5-yl)-N-[(2R)-1-pyridin-3-ylpropan-2-yl]acetamide
CID 99926874
ethyl 2-(3-pyridin-3-ylpropanoylamino)propanoate
CID 61344596
1-(3,4-dimethylphenyl)-3-pyridin-3-ylpropan-2-one
CID 62551189
N-(1-amino-4-methylpentan-2-yl)-3-pyridin-3-ylpropanamide
CID 81486896

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide?
The IUPAC name of 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide (CID 86286437) is 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide.
What is the SMILES notation for 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide?
The canonical SMILES for 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide is Cc1ccc(CCC(=O)NC(C)Cc2cccnc2)cc1C.
What is the InChIKey of 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide?
The InChIKey is PVZMRIIMTSREOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-14-6-7-17(11-15(14)2)8-9-19(22)21-16(3)12-18-5-4-10-20-13-18/h4-7,10-11,13,16H,8-9,12H2,1-3H3,(H,21,22).
What are the key properties of 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide?
3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide has a molecular weight of 296.41 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethylphenyl)-N-(1-pyridin-3-ylpropan-2-yl)propanamide is sourced from PubChem (CID 86286437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).