2-[2-(methylamino)ethyl]benzohydrazide

C10H15N3O — CID 104547939

IUPAC2-[2-(methylamino)ethyl]benzohydrazide
SMILESCNCCc1ccccc1C(=O)NN
InChIInChI=1S/C10H15N3O/c1-12-7-6-8-4-2-3-5-9(8)10(14)13-11/h2-5,12H,6-7,11H2,1H3,(H,13,14)
InChIKeyJVYDKXPXBYHUEP-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.05
Rot. Bonds4

About 2-[2-(methylamino)ethyl]benzohydrazide

2-[2-(methylamino)ethyl]benzohydrazide (PubChem CID 104547939) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-[2-(methylamino)ethyl]benzohydrazide.

Molecular Properties

Compound Name2-[2-(methylamino)ethyl]benzohydrazide
PubChem CID104547939
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name2-[2-(methylamino)ethyl]benzohydrazide
SMILESCNCCc1ccccc1C(=O)NN
InChIInChI=1S/C10H15N3O/c1-12-7-6-8-4-2-3-5-9(8)10(14)13-11/h2-5,12H,6-7,11H2,1H3,(H,13,14)
InChIKeyJVYDKXPXBYHUEP-UHFFFAOYSA-N
XLogP0.05
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

2-[2-(methylamino)ethyl]benzamide
CID 69094527
2-propylbenzohydrazide
CID 140653675
N-(1-amino-2-methyl-1-oxopropan-2-yl)-2-[2-(methylamino)ethyl]benzamide
CID 104547692
2-[2-(methylamino)ethyl]-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 104547416
3-[[2-[2-(methylamino)ethyl]benzoyl]amino]propanoic acid
CID 71070439
2-[2-(methylamino)ethyl]-N-prop-2-enylbenzamide
CID 104547357
2,2-dimethyl-1-[2-[2-(methylamino)ethyl]phenyl]propan-1-one
CID 116613271
N-(2-cyanoethyl)-2-[2-(methylamino)ethyl]benzamide
CID 113425664
1-[2-[2-(methylamino)ethyl]phenyl]but-3-yn-1-one
CID 116613135
3-methyl-1-[2-[2-(methylamino)ethyl]phenyl]butan-1-one
CID 116613183
N,N-diethyl-2-[2-(methylamino)ethyl]benzamide
CID 104547231
N-[4-(hydroxymethyl)phenyl]-2-[2-(methylamino)ethyl]benzamide
CID 104548252

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)ethyl]benzohydrazide?
The IUPAC name of 2-[2-(methylamino)ethyl]benzohydrazide (CID 104547939) is 2-[2-(methylamino)ethyl]benzohydrazide.
What is the SMILES notation for 2-[2-(methylamino)ethyl]benzohydrazide?
The canonical SMILES for 2-[2-(methylamino)ethyl]benzohydrazide is CNCCc1ccccc1C(=O)NN.
What is the InChIKey of 2-[2-(methylamino)ethyl]benzohydrazide?
The InChIKey is JVYDKXPXBYHUEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-12-7-6-8-4-2-3-5-9(8)10(14)13-11/h2-5,12H,6-7,11H2,1H3,(H,13,14).
What are the key properties of 2-[2-(methylamino)ethyl]benzohydrazide?
2-[2-(methylamino)ethyl]benzohydrazide has a molecular weight of 193.25 g/mol, XLogP of 0.05, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)ethyl]benzohydrazide is sourced from PubChem (CID 104547939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).