(2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide

C16H20N4O — CID 78984805

IUPAC(2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide
SMILESCN(C)c1ccncc1NC(=O)[C@H](N)Cc1ccccc1
InChIInChI=1S/C16H20N4O/c1-20(2)15-8-9-18-11-14(15)19-16(21)13(17)10-12-6-4-3-5-7-12/h3-9,11,13H,10,17H2,1-2H3,(H,19,21)/t13-/m1/s1
InChIKeyPIXNNSYSMQACPU-CYBMUJFWSA-N
MW284.36 g/mol
LogP1.66
Rot. Bonds5

About (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide

(2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide (PubChem CID 78984805) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide
PubChem CID78984805
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name(2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide
SMILESCN(C)c1ccncc1NC(=O)[C@H](N)Cc1ccccc1
InChIInChI=1S/C16H20N4O/c1-20(2)15-8-9-18-11-14(15)19-16(21)13(17)10-12-6-4-3-5-7-12/h3-9,11,13H,10,17H2,1-2H3,(H,19,21)/t13-/m1/s1
InChIKeyPIXNNSYSMQACPU-CYBMUJFWSA-N
XLogP1.66
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 ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(dimethylamino)phenyl]-3-phenylpropanamide
CID 43710155
2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3,3-dimethylbutanamide
CID 76893750
(2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3,3-dimethylbutanamide
CID 103928632
2-bromo-N-[4-(dimethylamino)-3-pyridinyl]propanamide
CID 107903618
3-amino-N-[4-(dimethylamino)-3-pyridinyl]butanamide
CID 60837788
(2S)-2-amino-N-(5-methyl-1H-pyrazol-4-yl)-3-phenylpropanamide
CID 110837650
(2S)-2-amino-N-(2-methyl-3-pyridinyl)-3-phenylpropanamide
CID 54173969
(2S)-2-amino-N-(2-methylphenyl)-3-phenylpropanamide
CID 22691205
phenyl N-[4-(dimethylamino)-3-pyridinyl]carbamate
CID 63374978
3-amino-2-benzyl-N-(4-methyl-3-pyridinyl)-3-sulfanylidenepropanamide
CID 63327676
4-N,4-N-dimethyl-3-N-(4-phenylbutan-2-yl)pyridine-3,4-diamine
CID 43678643
(2S)-2-amino-N-[(2S)-2-amino-3-phenylpropanoyl]-3-phenylpropanamide
CID 21116073

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide?
The IUPAC name of (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide (CID 78984805) is (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide?
The canonical SMILES for (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide is CN(C)c1ccncc1NC(=O)[C@H](N)Cc1ccccc1.
What is the InChIKey of (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide?
The InChIKey is PIXNNSYSMQACPU-CYBMUJFWSA-N. The full InChI is InChI=1S/C16H20N4O/c1-20(2)15-8-9-18-11-14(15)19-16(21)13(17)10-12-6-4-3-5-7-12/h3-9,11,13H,10,17H2,1-2H3,(H,19,21)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide?
(2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide has a molecular weight of 284.36 g/mol, XLogP of 1.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[4-(dimethylamino)-3-pyridinyl]-3-phenylpropanamide is sourced from PubChem (CID 78984805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).