N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide

C19H18N2OS — CID 39477042

IUPACN'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide
SMILESCc1ccsc1C(=O)NN(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C19H18N2OS/c1-15-12-13-23-18(15)19(22)20-21(17-10-6-3-7-11-17)14-16-8-4-2-5-9-16/h2-13H,14H2,1H3,(H,20,22)
InChIKeySFWFTIOMLPATLY-UHFFFAOYSA-N
MW322.43 g/mol
LogP4.41
Rot. Bonds5

About N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide

N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide (PubChem CID 39477042) has the molecular formula C19H18N2OS and a molecular weight of 322.43 g/mol. Its IUPAC name is N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide.

Molecular Properties

Compound NameN'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide
PubChem CID39477042
Molecular FormulaC19H18N2OS
Molecular Weight322.43 g/mol
Exact Mass322.11
IUPAC NameN'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide
SMILESCc1ccsc1C(=O)NN(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C19H18N2OS/c1-15-12-13-23-18(15)19(22)20-21(17-10-6-3-7-11-17)14-16-8-4-2-5-9-16/h2-13H,14H2,1H3,(H,20,22)
InChIKeySFWFTIOMLPATLY-UHFFFAOYSA-N
XLogP4.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.43
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-benzyl-N'-phenylfuran-2-carbohydrazide
CID 18884695
3-methyl-N-phenylmethoxythiophene-2-carboxamide
CID 30796107
1-(3-methylthiophen-2-yl)-3-phenylpropan-1-one
CID 59179659
N'-benzyl-3-methyl-N'-phenylbutanehydrazide
CID 39477039
N'-benzyl-2,2,2-trifluoro-N'-phenylacetohydrazide
CID 71671643
N-[5-[(N-benzylanilino)carbamoyl]-2-fluorophenyl]acetamide
CID 60564656
3-methyl-N-phenacylthiophene-2-carboxamide
CID 64991702
N'-benzyl-N'-phenylpyridine-3-carbohydrazide
CID 51156325
N'-benzyl-N'-phenyl-2-(trifluoromethyl)benzohydrazide
CID 55342142
[2-(dibenzylamino)-2-oxoethyl] 3-methylthiophene-2-carboxylate
CID 7504988
N'-benzyl-N'-phenyl-1H-thieno[3,2-d]pyrazole-5-carbohydrazide
CID 141152678
3-methyl-N-(2-methylphenyl)thiophene-2-carboxamide
CID 8714089

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide?
The IUPAC name of N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide (CID 39477042) is N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide.
What is the SMILES notation for N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide?
The canonical SMILES for N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide is Cc1ccsc1C(=O)NN(Cc1ccccc1)c1ccccc1.
What is the InChIKey of N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide?
The InChIKey is SFWFTIOMLPATLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2OS/c1-15-12-13-23-18(15)19(22)20-21(17-10-6-3-7-11-17)14-16-8-4-2-5-9-16/h2-13H,14H2,1H3,(H,20,22).
What are the key properties of N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide?
N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide has a molecular weight of 322.43 g/mol, XLogP of 4.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-3-methyl-N'-phenylthiophene-2-carbohydrazide is sourced from PubChem (CID 39477042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).