N-methyl-4-(4-phenylphenyl)butanehydrazide

C17H20N2O — CID 116845103

IUPACN-methyl-4-(4-phenylphenyl)butanehydrazide
SMILESCN(N)C(=O)CCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H20N2O/c1-19(18)17(20)9-5-6-14-10-12-16(13-11-14)15-7-3-2-4-8-15/h2-4,7-8,10-13H,5-6,9,18H2,1H3
InChIKeyOABCGUNKDQGOBY-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.01
Rot. Bonds5

About N-methyl-4-(4-phenylphenyl)butanehydrazide

N-methyl-4-(4-phenylphenyl)butanehydrazide (PubChem CID 116845103) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-methyl-4-(4-phenylphenyl)butanehydrazide.

Molecular Properties

Compound NameN-methyl-4-(4-phenylphenyl)butanehydrazide
PubChem CID116845103
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-methyl-4-(4-phenylphenyl)butanehydrazide
SMILESCN(N)C(=O)CCCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C17H20N2O/c1-19(18)17(20)9-5-6-14-10-12-16(13-11-14)15-7-3-2-4-8-15/h2-4,7-8,10-13H,5-6,9,18H2,1H3
InChIKeyOABCGUNKDQGOBY-UHFFFAOYSA-N
XLogP3.01
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

N-methyl-4-naphthalen-2-ylbutanehydrazide
CID 116845183
5-(4-ethoxyphenyl)-N-methylpentanehydrazide
CID 116845228
4-(2,3-dihydro-1H-inden-5-yl)-N-methylbutanehydrazide
CID 116845082
3-(4-ethylphenyl)-N-methylpropanehydrazide
CID 116844908
N-methyl-4-phenyl-N-propan-2-ylbutanamide
CID 78884220
ethane;3-(4-phenylphenyl)propanoic acid
CID 91257280
N-(1-aminopropan-2-yl)-N-methyl-4-phenylbutanamide
CID 112701398
2-methyl-5-(4-phenylphenyl)pentanoic acid
CID 56631136
N-(2-chloroethyl)-N-methyl-4-phenylbutanamide
CID 63391707
N-amino-N-nitroso-3-[4-(3-phenylpropyl)phenyl]propanamide
CID 89335442
1-(4-phenylphenyl)pentan-3-one
CID 58444061
N-hydroxy-3-(4-phenylphenyl)propanamide
CID 22915508

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(4-phenylphenyl)butanehydrazide?
The IUPAC name of N-methyl-4-(4-phenylphenyl)butanehydrazide (CID 116845103) is N-methyl-4-(4-phenylphenyl)butanehydrazide.
What is the SMILES notation for N-methyl-4-(4-phenylphenyl)butanehydrazide?
The canonical SMILES for N-methyl-4-(4-phenylphenyl)butanehydrazide is CN(N)C(=O)CCCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-methyl-4-(4-phenylphenyl)butanehydrazide?
The InChIKey is OABCGUNKDQGOBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-19(18)17(20)9-5-6-14-10-12-16(13-11-14)15-7-3-2-4-8-15/h2-4,7-8,10-13H,5-6,9,18H2,1H3.
What are the key properties of N-methyl-4-(4-phenylphenyl)butanehydrazide?
N-methyl-4-(4-phenylphenyl)butanehydrazide has a molecular weight of 268.36 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(4-phenylphenyl)butanehydrazide is sourced from PubChem (CID 116845103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).