N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide

C19H19N3O3 — CID 111116122

IUPACN-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
SMILESO=C(Nc1ccc(OCCO)cc1)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C19H19N3O3/c23-12-13-25-18-8-6-17(7-9-18)21-19(24)16-4-2-15(3-5-16)14-22-11-1-10-20-22/h1-11,23H,12-14H2,(H,21,24)
InChIKeySFMIYXZOPMEEBN-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.55
Rot. Bonds7

About N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide

N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide (PubChem CID 111116122) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide.

Molecular Properties

Compound NameN-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
PubChem CID111116122
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
SMILESO=C(Nc1ccc(OCCO)cc1)c1ccc(Cn2cccn2)cc1
InChIInChI=1S/C19H19N3O3/c23-12-13-25-18-8-6-17(7-9-18)21-19(24)16-4-2-15(3-5-16)14-22-11-1-10-20-22/h1-11,23H,12-14H2,(H,21,24)
InChIKeySFMIYXZOPMEEBN-UHFFFAOYSA-N
XLogP2.55
TPSA76.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(2-hydroxyethoxy)phenyl]-4-pyrazol-1-ylbenzamide
CID 111116155
N-[4-(diethylamino)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 134036419
N-[4-(pyrazol-1-ylmethyl)phenyl]-1H-pyrazole-4-carboxamide
CID 60934045
4-(pyrazol-1-ylmethyl)-N-thiophen-3-ylbenzamide
CID 175249041
N-[4-(1,3-oxazol-5-yl)phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 78890208
4-ethoxy-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]benzamide
CID 25403941
4-propan-2-ylsulfonyl-N-[4-(pyrazol-1-ylmethyl)phenyl]benzamide
CID 55970703
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methylphenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 26045640
4-(pyrazol-1-ylmethyl)-N-[3-(trifluoromethoxy)phenyl]benzamide
CID 38209826
4-tert-butyl-N-[4-(2-hydroxyethoxy)phenyl]benzamide
CID 14698589
2-chloro-4-[[4-(pyrazol-1-ylmethyl)benzoyl]amino]benzamide
CID 39170149
N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]-4-(pyrazol-1-ylmethyl)benzamide
CID 39041372

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The IUPAC name of N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide (CID 111116122) is N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide.
What is the SMILES notation for N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The canonical SMILES for N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide is O=C(Nc1ccc(OCCO)cc1)c1ccc(Cn2cccn2)cc1.
What is the InChIKey of N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
The InChIKey is SFMIYXZOPMEEBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c23-12-13-25-18-8-6-17(7-9-18)21-19(24)16-4-2-15(3-5-16)14-22-11-1-10-20-22/h1-11,23H,12-14H2,(H,21,24).
What are the key properties of N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide?
N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide has a molecular weight of 337.38 g/mol, XLogP of 2.55, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-hydroxyethoxy)phenyl]-4-(pyrazol-1-ylmethyl)benzamide is sourced from PubChem (CID 111116122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).