3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide

C10H14ClN3O — CID 116849632

IUPAC3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide
SMILESCNNC(=O)CC(N)c1ccc(Cl)cc1
InChIInChI=1S/C10H14ClN3O/c1-13-14-10(15)6-9(12)7-2-4-8(11)5-3-7/h2-5,9,13H,6,12H2,1H3,(H,14,15)
InChIKeyZIMHFXDOOXPVDL-UHFFFAOYSA-N
MW227.70 g/mol
LogP0.98
Rot. Bonds4

About 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide

3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide (PubChem CID 116849632) has the molecular formula C10H14ClN3O and a molecular weight of 227.70 g/mol. Its IUPAC name is 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide.

Molecular Properties

Compound Name3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide
PubChem CID116849632
Molecular FormulaC10H14ClN3O
Molecular Weight227.70 g/mol
Exact Mass227.08
IUPAC Name3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide
SMILESCNNC(=O)CC(N)c1ccc(Cl)cc1
InChIInChI=1S/C10H14ClN3O/c1-13-14-10(15)6-9(12)7-2-4-8(11)5-3-7/h2-5,9,13H,6,12H2,1H3,(H,14,15)
InChIKeyZIMHFXDOOXPVDL-UHFFFAOYSA-N
XLogP0.98
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.70
LogP ≤ 50.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide 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

3-amino-3-(4-ethylsulfanylphenyl)-N'-methylpropanehydrazide
CID 116849699
3-amino-3-(4-chlorophenyl)propanoic acid;azane
CID 175752194
(3S)-3-amino-3-(4-chlorophenyl)propanamide
CID 29060060
(3S)-3-amino-N-[(1S)-1-(4-chlorophenyl)propyl]-3-phenylpropanamide
CID 124684118
ethyl 3-amino-3-(4-chlorophenyl)propanoate;hydrochloride
CID 2847356
3-amino-N'-methyl-3-(2-methyl-5-propan-2-ylphenyl)propanehydrazide
CID 116849694
3-amino-N-[(4-chlorophenyl)methyl]-3-phenylpropanamide
CID 43208733
2-(4-chlorophenyl)-N'-methylpropanehydrazide
CID 116846979
(3R)-3-amino-3-[4-(methylamino)phenyl]propanoic acid
CID 130649436
3-amino-N'-methyl-3-(2-methyl-3H-benzimidazol-5-yl)propanehydrazide
CID 116849707
methyl (3R)-3-amino-3-(3-chloro-4-fluorophenyl)propanoate
CID 79021226
methyl 3-amino-3-(4-propan-2-ylphenyl)propanoate;hydrochloride
CID 137346948

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide?
The IUPAC name of 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide (CID 116849632) is 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide.
What is the SMILES notation for 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide?
The canonical SMILES for 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide is CNNC(=O)CC(N)c1ccc(Cl)cc1.
What is the InChIKey of 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide?
The InChIKey is ZIMHFXDOOXPVDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN3O/c1-13-14-10(15)6-9(12)7-2-4-8(11)5-3-7/h2-5,9,13H,6,12H2,1H3,(H,14,15).
What are the key properties of 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide?
3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide has a molecular weight of 227.70 g/mol, XLogP of 0.98, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-(4-chlorophenyl)-N'-methylpropanehydrazide is sourced from PubChem (CID 116849632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).