(2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide

C10H16N4O — CID 67278744

IUPAC(2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide
SMILESCN(C)[C@@](N)(Cc1ccccn1)C(N)=O
InChIInChI=1S/C10H16N4O/c1-14(2)10(12,9(11)15)7-8-5-3-4-6-13-8/h3-6H,7,12H2,1-2H3,(H2,11,15)/t10-/m0/s1
InChIKeySRFBTSSNFQTSCO-JTQLQIEISA-N
MW208.27 g/mol
LogP-0.67
Rot. Bonds4

About (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide

(2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide (PubChem CID 67278744) has the molecular formula C10H16N4O and a molecular weight of 208.27 g/mol. Its IUPAC name is (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide.

Molecular Properties

Compound Name(2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide
PubChem CID67278744
Molecular FormulaC10H16N4O
Molecular Weight208.27 g/mol
Exact Mass208.13
IUPAC Name(2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide
SMILESCN(C)[C@@](N)(Cc1ccccn1)C(N)=O
InChIInChI=1S/C10H16N4O/c1-14(2)10(12,9(11)15)7-8-5-3-4-6-13-8/h3-6H,7,12H2,1-2H3,(H2,11,15)/t10-/m0/s1
InChIKeySRFBTSSNFQTSCO-JTQLQIEISA-N
XLogP-0.67
TPSA85.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.27
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

N'-methyl-N'-(pyridin-2-ylmethyl)oxamide
CID 115192026
2-amino-2-(pyridin-2-ylmethyl)propane-1,3-diol;dihydrochloride
CID 23111151
(3S)-3-amino-3-methyl-4-pyridin-2-ylbutan-1-ol
CID 135132634
2-amino-2-methyl-N-phenyl-3-pyridin-2-ylpropanamide
CID 68993510
1-hydroxy-1-(pyridin-2-ylmethyl)urea
CID 10374807
diethyl 2-ethyl-2-(pyridin-2-ylmethyl)propanedioate
CID 103973006
2-amino-3-(pyridin-2-ylmethoxy)propanamide
CID 83213494
3-amino-3-hydroxyimino-N,2,2-trimethyl-N-(2-pyridin-2-ylethyl)propanamide
CID 76919338
4-[methyl(pyridin-2-ylmethyl)amino]pyridine-2-carboxamide
CID 171327108
2-[methyl(pyridin-2-ylmethyl)amino]-1,3-thiazole-5-carboxylic acid
CID 55112267
molecular hydrogen;2-pyridin-2-ylacetamide
CID 145224814
4-amino-N-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 43564701

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide?
The IUPAC name of (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide (CID 67278744) is (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide.
What is the SMILES notation for (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide?
The canonical SMILES for (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide is CN(C)[C@@](N)(Cc1ccccn1)C(N)=O.
What is the InChIKey of (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide?
The InChIKey is SRFBTSSNFQTSCO-JTQLQIEISA-N. The full InChI is InChI=1S/C10H16N4O/c1-14(2)10(12,9(11)15)7-8-5-3-4-6-13-8/h3-6H,7,12H2,1-2H3,(H2,11,15)/t10-/m0/s1.
What are the key properties of (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide?
(2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide has a molecular weight of 208.27 g/mol, XLogP of -0.67, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-2-(dimethylamino)-3-pyridin-2-ylpropanamide is sourced from PubChem (CID 67278744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).