2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide

C17H16N4O — CID 166339816

IUPAC2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide
SMILESO=C(Cn1cccn1)NCc1ccccc1-c1cccnc1
InChIInChI=1S/C17H16N4O/c22-17(13-21-10-4-9-20-21)19-12-15-5-1-2-7-16(15)14-6-3-8-18-11-14/h1-11H,12-13H2,(H,19,22)
InChIKeyIAOUEANGNQESMC-UHFFFAOYSA-N
MW292.34 g/mol
LogP2.26
Rot. Bonds5

About 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide

2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide (PubChem CID 166339816) has the molecular formula C17H16N4O and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide
PubChem CID166339816
Molecular FormulaC17H16N4O
Molecular Weight292.34 g/mol
Exact Mass292.13
IUPAC Name2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide
SMILESO=C(Cn1cccn1)NCc1ccccc1-c1cccnc1
InChIInChI=1S/C17H16N4O/c22-17(13-21-10-4-9-20-21)19-12-15-5-1-2-7-16(15)14-6-3-8-18-11-14/h1-11H,12-13H2,(H,19,22)
InChIKeyIAOUEANGNQESMC-UHFFFAOYSA-N
XLogP2.26
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-chlorophenyl)methyl]-2-pyrazol-1-ylacetamide
CID 39724151
2-(2,4-difluorophenyl)-N-[(2-pyridin-3-ylphenyl)methyl]acetamide
CID 166339826
N-(2-phenylphenyl)-2-pyrazol-1-ylacetamide
CID 39723144
N-(naphthalen-1-ylmethyl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 112816203
N-[[4-(aminomethyl)phenyl]methyl]-2-pyrazol-1-ylacetamide
CID 81090478
N-[[2-[4-(pyrazol-1-ylmethyl)phenyl]phenyl]methyl]-2-thiophen-2-ylacetamide
CID 56548066
2-methyl-3-(methylamino)-N-[[2-[4-(pyrazol-1-ylmethyl)phenyl]phenyl]methyl]propanamide
CID 119759392
N-[2-oxo-2-[[2-[4-(pyrazol-1-ylmethyl)phenyl]phenyl]methylamino]ethyl]cyclopentanecarboxamide
CID 86883256
N-[(2-fluorophenyl)methyl]-2-[(4-methyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
CID 27941362
2-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 801778
N-[2-[(2-phenoxyacetyl)amino]ethyl]-2-pyrazol-1-ylacetamide
CID 47029028
N-[(2-fluorophenyl)methyl]-1-[(2-pyridin-3-ylphenyl)methyl]piperidine-4-carboxamide
CID 134802499

Frequently Asked Questions

What is the IUPAC name of 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide?
The IUPAC name of 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide (CID 166339816) is 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide.
What is the SMILES notation for 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide?
The canonical SMILES for 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide is O=C(Cn1cccn1)NCc1ccccc1-c1cccnc1.
What is the InChIKey of 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide?
The InChIKey is IAOUEANGNQESMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O/c22-17(13-21-10-4-9-20-21)19-12-15-5-1-2-7-16(15)14-6-3-8-18-11-14/h1-11H,12-13H2,(H,19,22).
What are the key properties of 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide?
2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide has a molecular weight of 292.34 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazol-1-yl-N-[(2-pyridin-3-ylphenyl)methyl]acetamide is sourced from PubChem (CID 166339816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).