N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide

C20H18N4O2 — CID 126544270

IUPACN-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide
SMILESNNC(=O)c1ccc(CN(C(=O)c2ccncc2)c2ccccc2)cc1
InChIInChI=1S/C20H18N4O2/c21-23-19(25)16-8-6-15(7-9-16)14-24(18-4-2-1-3-5-18)20(26)17-10-12-22-13-11-17/h1-13H,14,21H2,(H,23,25)
InChIKeyKUYHDPPGOBANAF-UHFFFAOYSA-N
MW346.39 g/mol
LogP2.53
Rot. Bonds5

About N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide

N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide (PubChem CID 126544270) has the molecular formula C20H18N4O2 and a molecular weight of 346.39 g/mol. Its IUPAC name is N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide
PubChem CID126544270
Molecular FormulaC20H18N4O2
Molecular Weight346.39 g/mol
Exact Mass346.14
IUPAC NameN-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide
SMILESNNC(=O)c1ccc(CN(C(=O)c2ccncc2)c2ccccc2)cc1
InChIInChI=1S/C20H18N4O2/c21-23-19(25)16-8-6-15(7-9-16)14-24(18-4-2-1-3-5-18)20(26)17-10-12-22-13-11-17/h1-13H,14,21H2,(H,23,25)
InChIKeyKUYHDPPGOBANAF-UHFFFAOYSA-N
XLogP2.53
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[4-(hydrazinecarbonyl)phenyl]methyl-phenylcarbamic acid
CID 134584304
N-[[4-[[(2,2-difluoroacetyl)amino]carbamoyl]phenyl]methyl]-N-phenylpyridine-4-carboxamide
CID 134568607
3-benzyl-1-[[4-(hydrazinecarbonyl)phenyl]methyl]-1-phenylurea
CID 140895002
N-phenyl-N-[[4-[[(2,2,2-trifluoroacetyl)amino]carbamoyl]phenyl]methyl]benzamide
CID 126544300
N-benzyl-4-chloro-N-phenylbenzamide
CID 20787883
N-benzyl-4-bromo-N-phenylbenzamide
CID 15817231
CID 69045386
CID 69045386
N-phenyl-N-[[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]phenyl]methyl]pyridine-4-carboxamide
CID 126544271
methyl 4-[benzyl(phenyl)carbamoyl]benzoate
CID 24819418
4-N-benzyl-1-N-butan-2-yl-4-N-phenylbenzene-1,4-dicarboxamide
CID 109044170
N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpiperazine-1-carboxamide
CID 134584488
N-benzyl-N-phenylpyridine-3-carboxamide;hydrochloride
CID 110756627

Frequently Asked Questions

What is the IUPAC name of N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide?
The IUPAC name of N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide (CID 126544270) is N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide.
What is the SMILES notation for N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide?
The canonical SMILES for N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide is NNC(=O)c1ccc(CN(C(=O)c2ccncc2)c2ccccc2)cc1.
What is the InChIKey of N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide?
The InChIKey is KUYHDPPGOBANAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4O2/c21-23-19(25)16-8-6-15(7-9-16)14-24(18-4-2-1-3-5-18)20(26)17-10-12-22-13-11-17/h1-13H,14,21H2,(H,23,25).
What are the key properties of N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide?
N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide has a molecular weight of 346.39 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(hydrazinecarbonyl)phenyl]methyl]-N-phenylpyridine-4-carboxamide is sourced from PubChem (CID 126544270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).