N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide

C13H16N4O2 — CID 47177158

IUPACN-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide
SMILESCCOc1ncccc1NC(=O)C(C)n1cccn1
InChIInChI=1S/C13H16N4O2/c1-3-19-13-11(6-4-7-14-13)16-12(18)10(2)17-9-5-8-15-17/h4-10H,3H2,1-2H3,(H,16,18)
InChIKeyAKCIIQWLQHBBJO-UHFFFAOYSA-N
MW260.30 g/mol
LogP1.88
Rot. Bonds5

About N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide

N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide (PubChem CID 47177158) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide
PubChem CID47177158
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC NameN-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide
SMILESCCOc1ncccc1NC(=O)C(C)n1cccn1
InChIInChI=1S/C13H16N4O2/c1-3-19-13-11(6-4-7-14-13)16-12(18)10(2)17-9-5-8-15-17/h4-10H,3H2,1-2H3,(H,16,18)
InChIKeyAKCIIQWLQHBBJO-UHFFFAOYSA-N
XLogP1.88
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-ethoxy-3-pyridinyl)-2-methyl-3-(methylamino)propanamide
CID 79196186
(2S)-N-[(2-ethoxy-3-pyridinyl)methyl]-2-pyrazol-1-ylbutanamide
CID 97151638
(2S)-2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 61178380
2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 43706630
N-(2-tert-butylphenyl)-2-pyrazol-1-ylpropanamide
CID 47156271
2-amino-N-(2-ethoxy-3-pyridinyl)-2-phenylacetamide
CID 43706621
N-(2-cyanophenyl)-2-pyrazol-1-ylpropanamide
CID 43187533
N-methyl-2-(2-pyrazol-1-ylpropanoylamino)benzamide
CID 43055255
N-(4-bromo-2-ethylphenyl)-2-pyrazol-1-ylpropanamide
CID 81004249
N-phenyl-2-pyrazol-1-ylpropanamide
CID 42949018
N-(2-bromo-3-chlorophenyl)-2-pyrazol-1-ylpropanamide
CID 103479974
(2R)-2-pyrazol-1-yl-N-[[2-(2,2,2-trifluoroethoxy)-3-pyridinyl]methyl]propanamide
CID 94022211

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide?
The IUPAC name of N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide (CID 47177158) is N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide.
What is the SMILES notation for N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide?
The canonical SMILES for N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide is CCOc1ncccc1NC(=O)C(C)n1cccn1.
What is the InChIKey of N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide?
The InChIKey is AKCIIQWLQHBBJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c1-3-19-13-11(6-4-7-14-13)16-12(18)10(2)17-9-5-8-15-17/h4-10H,3H2,1-2H3,(H,16,18).
What are the key properties of N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide?
N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide has a molecular weight of 260.30 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-3-pyridinyl)-2-pyrazol-1-ylpropanamide is sourced from PubChem (CID 47177158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).