3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide

C16H20N4O — CID 62876785

IUPAC3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide
SMILESCN(C)c1ccc(NC(=O)C(CN)c2ccccc2)cn1
InChIInChI=1S/C16H20N4O/c1-20(2)15-9-8-13(11-18-15)19-16(21)14(10-17)12-6-4-3-5-7-12/h3-9,11,14H,10,17H2,1-2H3,(H,19,21)
InChIKeyHYDQBOBWUOTGPV-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.83
Rot. Bonds5

About 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide

3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide (PubChem CID 62876785) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide
PubChem CID62876785
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide
SMILESCN(C)c1ccc(NC(=O)C(CN)c2ccccc2)cn1
InChIInChI=1S/C16H20N4O/c1-20(2)15-9-8-13(11-18-15)19-16(21)14(10-17)12-6-4-3-5-7-12/h3-9,11,14H,10,17H2,1-2H3,(H,19,21)
InChIKeyHYDQBOBWUOTGPV-UHFFFAOYSA-N
XLogP1.83
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-(6-fluoro-3-pyridinyl)-2-phenylpropanamide
CID 103808686
(3S)-3-(carbamoylamino)-N-[6-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide
CID 94017927
4-amino-5-[[6-(dimethylamino)-3-pyridinyl]amino]-5-oxopentanoic acid
CID 64894459
N-(4-acetylphenyl)-3-amino-2-phenylpropanamide
CID 62877329
3-amino-N-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenylpropanamide
CID 119844203
2-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-(4-methylphenyl)acetamide
CID 106312117
4-[(3-amino-2-phenylpropanoyl)amino]-N,N-diethylbenzamide;hydrochloride
CID 119684154
(2R)-2-amino-N-[6-(dimethylamino)-3-pyridinyl]-4-methylsulfonylbutanamide
CID 146149113
2-[[6-(dimethylamino)-3-pyridinyl]carbamoyl]benzoic acid
CID 60941938
benzyl N-[(2S,3S)-1-[[6-(dimethylamino)-3-pyridinyl]amino]-3-methyl-1-oxopentan-2-yl]carbamate
CID 30271496
3-amino-N-(1,3-benzothiazol-6-yl)-2-phenylpropanamide
CID 103809401
(2R)-N-[[6-(dimethylamino)-3-pyridinyl]methyl]-2-[ethyl(methyl)amino]-2-phenylacetamide
CID 94750528

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide?
The IUPAC name of 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide (CID 62876785) is 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide is CN(C)c1ccc(NC(=O)C(CN)c2ccccc2)cn1.
What is the InChIKey of 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide?
The InChIKey is HYDQBOBWUOTGPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-20(2)15-9-8-13(11-18-15)19-16(21)14(10-17)12-6-4-3-5-7-12/h3-9,11,14H,10,17H2,1-2H3,(H,19,21).
What are the key properties of 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide?
3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide has a molecular weight of 284.36 g/mol, XLogP of 1.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[6-(dimethylamino)-3-pyridinyl]-2-phenylpropanamide is sourced from PubChem (CID 62876785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).