3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide

C13H17N5O — CID 115426322

IUPAC3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
SMILESCC(C)(CN)C(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C13H17N5O/c1-13(2,9-14)12(19)17-10-5-3-6-15-11(10)18-8-4-7-16-18/h3-8H,9,14H2,1-2H3,(H,17,19)
InChIKeyDUTGGGPZNLGSJA-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.19
Rot. Bonds4

About 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide

3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide (PubChem CID 115426322) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
PubChem CID115426322
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
SMILESCC(C)(CN)C(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C13H17N5O/c1-13(2,9-14)12(19)17-10-5-3-6-15-11(10)18-8-4-7-16-18/h3-8H,9,14H2,1-2H3,(H,17,19)
InChIKeyDUTGGGPZNLGSJA-UHFFFAOYSA-N
XLogP1.19
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
CID 103028916
3-amino-2,2-dimethyl-N-(2-pyrrolidin-1-yl-3-pyridinyl)propanamide
CID 115426176
5-amino-4-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 82011031
7-amino-N-(2-pyrazol-1-yl-3-pyridinyl)heptanamide
CID 43714218
2,2,2-trifluoroethyl N-(2-pyrazol-1-yl-3-pyridinyl)carbamate
CID 47002174
(2S)-2-amino-3-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide
CID 61180497
2-amino-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714225
2-amino-4-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714222
(2S,3S)-2-amino-3-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 61180684
2-chloro-N-(2-pyrazol-1-yl-3-pyridinyl)pyridine-3-carboxamide
CID 60748520
2-phenylsulfanyl-N-(2-pyrazol-1-yl-3-pyridinyl)acetamide
CID 38749928
3-methyl-5-oxo-5-[(2-pyrazol-1-yl-3-pyridinyl)amino]pentanoic acid
CID 62966283

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The IUPAC name of 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide (CID 115426322) is 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide.
What is the SMILES notation for 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The canonical SMILES for 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide is CC(C)(CN)C(=O)Nc1cccnc1-n1cccn1.
What is the InChIKey of 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The InChIKey is DUTGGGPZNLGSJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-13(2,9-14)12(19)17-10-5-3-6-15-11(10)18-8-4-7-16-18/h3-8H,9,14H2,1-2H3,(H,17,19).
What are the key properties of 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide has a molecular weight of 259.31 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide is sourced from PubChem (CID 115426322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).