2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide

C17H16N4O2 — CID 43063138

IUPAC2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C17H16N4O2/c1-13(23-14-7-3-2-4-8-14)17(22)20-15-9-5-10-18-16(15)21-12-6-11-19-21/h2-13H,1H3,(H,20,22)
InChIKeyDWYTWNAYTXXJEH-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.67
Rot. Bonds5

About 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide

2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide (PubChem CID 43063138) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide.

Molecular Properties

Compound Name2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
PubChem CID43063138
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC Name2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
SMILESCC(Oc1ccccc1)C(=O)Nc1cccnc1-n1cccn1
InChIInChI=1S/C17H16N4O2/c1-13(23-14-7-3-2-4-8-14)17(22)20-15-9-5-10-18-16(15)21-12-6-11-19-21/h2-13H,1H3,(H,20,22)
InChIKeyDWYTWNAYTXXJEH-UHFFFAOYSA-N
XLogP2.67
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-(2-fluorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
CID 39166908
(2R)-2-(2-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
CID 39166910
2-phenoxy-N-[(2-pyrazol-1-yl-3-pyridinyl)methyl]propanamide
CID 46431766
(2S)-2-amino-3-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)butanamide
CID 61180497
(2S,3S)-2-amino-3-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 61180684
2-amino-4-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714222
2-phenoxy-N-quinolin-5-ylpropanamide
CID 18076800
2-amino-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714225
2-methoxy-2-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide
CID 103028916
4-amino-5-oxo-5-[(2-pyrazol-1-yl-3-pyridinyl)amino]pentanoic acid
CID 64889290
3-methyl-5-oxo-5-[(2-pyrazol-1-yl-3-pyridinyl)amino]pentanoic acid
CID 62966283
N-naphthalen-1-yl-2-phenoxypropanamide
CID 2794096

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The IUPAC name of 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide (CID 43063138) is 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide.
What is the SMILES notation for 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The canonical SMILES for 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide is CC(Oc1ccccc1)C(=O)Nc1cccnc1-n1cccn1.
What is the InChIKey of 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
The InChIKey is DWYTWNAYTXXJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-13(23-14-7-3-2-4-8-14)17(22)20-15-9-5-10-18-16(15)21-12-6-11-19-21/h2-13H,1H3,(H,20,22).
What are the key properties of 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide?
2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide has a molecular weight of 308.34 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-(2-pyrazol-1-yl-3-pyridinyl)propanamide is sourced from PubChem (CID 43063138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).