N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide

C20H17N3O3 — CID 164543754

IUPACN-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(C(=O)NO)c(-c2ccccc2)c1)c1cccnc1
InChIInChI=1S/C20H17N3O3/c24-19(16-7-4-10-21-13-16)22-12-14-8-9-17(20(25)23-26)18(11-14)15-5-2-1-3-6-15/h1-11,13,26H,12H2,(H,22,24)(H,23,25)
InChIKeyOTMLEGPPZHWFIW-UHFFFAOYSA-N
MW347.37 g/mol
LogP2.80
Rot. Bonds5

About N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide

N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide (PubChem CID 164543754) has the molecular formula C20H17N3O3 and a molecular weight of 347.37 g/mol. Its IUPAC name is N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide
PubChem CID164543754
Molecular FormulaC20H17N3O3
Molecular Weight347.37 g/mol
Exact Mass347.13
IUPAC NameN-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(C(=O)NO)c(-c2ccccc2)c1)c1cccnc1
InChIInChI=1S/C20H17N3O3/c24-19(16-7-4-10-21-13-16)22-12-14-8-9-17(20(25)23-26)18(11-14)15-5-2-1-3-6-15/h1-11,13,26H,12H2,(H,22,24)(H,23,25)
InChIKeyOTMLEGPPZHWFIW-UHFFFAOYSA-N
XLogP2.80
TPSA91.32 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.37
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-benzylpyridine-3-carboxamide chloride
CID 21204170
N-(pyridin-3-ylmethyl)pyridine-3-carboxamide;hydrochloride
CID 110755498
N-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyridine-3-carboxamide
CID 17164666
N-[(3-iodophenyl)methyl]pyridine-3-carboxamide
CID 125490904
N-[(4-carbamoylphenyl)methyl]pyridine-3-carboxamide
CID 108766189
N-[(4-phenylmethoxyphenyl)methyl]pyridine-3-carboxamide
CID 23130542
N-[[4-(2-aminoethyl)phenyl]methyl]pyridine-3-carboxamide
CID 62502833
N-[(3-carbamothioylphenyl)methyl]pyridine-3-carboxamide
CID 62311611
N-[(3,4-diethoxyphenyl)methyl]pyridine-3-carboxamide
CID 100629145
4-chloro-3-(4-phenylphenyl)-N-(pyridin-3-ylmethyl)benzamide
CID 58791127
N-[(4-tert-butylphenyl)methyl]pyridine-3-carboxamide;hydrochloride
CID 110779584
N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108925493

Frequently Asked Questions

What is the IUPAC name of N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide?
The IUPAC name of N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide (CID 164543754) is N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide?
The canonical SMILES for N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide is O=C(NCc1ccc(C(=O)NO)c(-c2ccccc2)c1)c1cccnc1.
What is the InChIKey of N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide?
The InChIKey is OTMLEGPPZHWFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O3/c24-19(16-7-4-10-21-13-16)22-12-14-8-9-17(20(25)23-26)18(11-14)15-5-2-1-3-6-15/h1-11,13,26H,12H2,(H,22,24)(H,23,25).
What are the key properties of N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide?
N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide has a molecular weight of 347.37 g/mol, XLogP of 2.80, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(hydroxycarbamoyl)-3-phenylphenyl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 164543754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).