N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide

C15H15N3O2 — CID 20661930

IUPACN-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(NNC=O)cc2)c1
InChIInChI=1S/C15H15N3O2/c1-11-3-2-4-12(9-11)15(20)17-13-5-7-14(8-6-13)18-16-10-19/h2-10,18H,1H3,(H,16,19)(H,17,20)
InChIKeyJIDVAYNECYICLZ-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.32
Rot. Bonds5

About N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide

N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide (PubChem CID 20661930) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide.

Molecular Properties

Compound NameN-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide
PubChem CID20661930
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2ccc(NNC=O)cc2)c1
InChIInChI=1S/C15H15N3O2/c1-11-3-2-4-12(9-11)15(20)17-13-5-7-14(8-6-13)18-16-10-19/h2-10,18H,1H3,(H,16,19)(H,17,20)
InChIKeyJIDVAYNECYICLZ-UHFFFAOYSA-N
XLogP2.32
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-formamidophenyl)-3-methylbenzamide
CID 168653169
N-(4-acetamidophenyl)-3-methylbenzamide
CID 730082
CID 87724838
CID 87724838
3-methyl-N-[4-[[(3-methylbenzoyl)amino]carbamoyl]phenyl]benzamide
CID 3426380
3-methyl-N-[4-(prop-2-enylamino)phenyl]benzamide
CID 112980083
N-[4-[(1S)-1-hydroxyethyl]phenyl]-3-methylbenzamide
CID 93040828
methyl 4-[[[4-[(3-methylbenzoyl)amino]benzoyl]amino]carbamoyl]benzoate
CID 17178369
N-[4-(diethylamino)phenyl]-3-methylbenzamide
CID 835431
N-(3-acetamidophenyl)-3-methylbenzamide
CID 766081
3-methyl-N-[4-[(2-methylphenyl)carbamoyl]phenyl]benzamide
CID 23857052
3-methyl-N-[4-[(2-phenylacetyl)amino]phenyl]benzamide
CID 5343922
2-iodo-N-[4-[(3-methylbenzoyl)amino]phenyl]benzamide
CID 1089815

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide?
The IUPAC name of N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide (CID 20661930) is N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide.
What is the SMILES notation for N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide?
The canonical SMILES for N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide is Cc1cccc(C(=O)Nc2ccc(NNC=O)cc2)c1.
What is the InChIKey of N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide?
The InChIKey is JIDVAYNECYICLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-11-3-2-4-12(9-11)15(20)17-13-5-7-14(8-6-13)18-16-10-19/h2-10,18H,1H3,(H,16,19)(H,17,20).
What are the key properties of N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide?
N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide has a molecular weight of 269.30 g/mol, XLogP of 2.32, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-formylhydrazinyl)phenyl]-3-methylbenzamide is sourced from PubChem (CID 20661930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).