N'-benzyl-2-methylprop-2-enehydrazide

C11H14N2O — CID 175049559

IUPACN'-benzyl-2-methylprop-2-enehydrazide
SMILESC=C(C)C(=O)NNCc1ccccc1
InChIInChI=1S/C11H14N2O/c1-9(2)11(14)13-12-8-10-6-4-3-5-7-10/h3-7,12H,1,8H2,2H3,(H,13,14)
InChIKeyGUCZUSGTFVBDCK-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.38
Rot. Bonds4

About N'-benzyl-2-methylprop-2-enehydrazide

N'-benzyl-2-methylprop-2-enehydrazide (PubChem CID 175049559) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is N'-benzyl-2-methylprop-2-enehydrazide.

Molecular Properties

Compound NameN'-benzyl-2-methylprop-2-enehydrazide
PubChem CID175049559
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC NameN'-benzyl-2-methylprop-2-enehydrazide
SMILESC=C(C)C(=O)NNCc1ccccc1
InChIInChI=1S/C11H14N2O/c1-9(2)11(14)13-12-8-10-6-4-3-5-7-10/h3-7,12H,1,8H2,2H3,(H,13,14)
InChIKeyGUCZUSGTFVBDCK-UHFFFAOYSA-N
XLogP1.38
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-methyl-N'-(4-phenylbutyl)prop-2-enehydrazide
CID 67732618
N-benzyl-2-methylprop-2-enamide;hydrazine
CID 157480946
methylamino 2-(2-benzylhydrazinyl)-2-oxoethanimidate
CID 139453472
benzyl N-(2-methylprop-2-enoyl)carbamate
CID 11321946
N'-benzyl-4,4-dimethylpentanehydrazide
CID 22069131
N'-ethyl-2-methylprop-2-enehydrazide
CID 18424014
N-benzylhydroxylamine;formaldehyde
CID 87671632
benzyl-dimethyl-[1-(2-methylprop-2-enoylamino)ethyl]azanium chloride
CID 87841033
N'-benzylhexadecanehydrazide
CID 154391297
(2R)-N'-benzyl-2,4-dihydroxy-3,3-dimethylbutanehydrazide
CID 3048066
(2R)-N'-benzyl-2-phenoxypropanehydrazide
CID 93092168
(benzylamino)carbamodithioic acid
CID 14849350

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-2-methylprop-2-enehydrazide?
The IUPAC name of N'-benzyl-2-methylprop-2-enehydrazide (CID 175049559) is N'-benzyl-2-methylprop-2-enehydrazide.
What is the SMILES notation for N'-benzyl-2-methylprop-2-enehydrazide?
The canonical SMILES for N'-benzyl-2-methylprop-2-enehydrazide is C=C(C)C(=O)NNCc1ccccc1.
What is the InChIKey of N'-benzyl-2-methylprop-2-enehydrazide?
The InChIKey is GUCZUSGTFVBDCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-9(2)11(14)13-12-8-10-6-4-3-5-7-10/h3-7,12H,1,8H2,2H3,(H,13,14).
What are the key properties of N'-benzyl-2-methylprop-2-enehydrazide?
N'-benzyl-2-methylprop-2-enehydrazide has a molecular weight of 190.25 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-2-methylprop-2-enehydrazide is sourced from PubChem (CID 175049559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).