2,2-diphenyl-N-propylacetohydrazide;hydrochloride

C17H21ClN2O — CID 139747660

IUPAC2,2-diphenyl-N-propylacetohydrazide;hydrochloride
SMILESCCCN(N)C(=O)C(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C17H20N2O.ClH/c1-2-13-19(18)17(20)16(14-9-5-3-6-10-14)15-11-7-4-8-12-15;/h3-12,16H,2,13,18H2,1H3;1H
InChIKeyHFAKKHMUTBMWFU-UHFFFAOYSA-N
MW304.82 g/mol
LogP3.35
Rot. Bonds5

About 2,2-diphenyl-N-propylacetohydrazide;hydrochloride

2,2-diphenyl-N-propylacetohydrazide;hydrochloride (PubChem CID 139747660) has the molecular formula C17H21ClN2O and a molecular weight of 304.82 g/mol. Its IUPAC name is 2,2-diphenyl-N-propylacetohydrazide;hydrochloride.

Molecular Properties

Compound Name2,2-diphenyl-N-propylacetohydrazide;hydrochloride
PubChem CID139747660
Molecular FormulaC17H21ClN2O
Molecular Weight304.82 g/mol
Exact Mass304.13
IUPAC Name2,2-diphenyl-N-propylacetohydrazide;hydrochloride
SMILESCCCN(N)C(=O)C(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C17H20N2O.ClH/c1-2-13-19(18)17(20)16(14-9-5-3-6-10-14)15-11-7-4-8-12-15;/h3-12,16H,2,13,18H2,1H3;1H
InChIKeyHFAKKHMUTBMWFU-UHFFFAOYSA-N
XLogP3.35
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.82
LogP ≤ 53.35
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'}

Analyze 2,2-diphenyl-N-propylacetohydrazide;hydrochloride 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,N-dimethyl-2,2-diphenylacetamide
CID 19693860
bis(N,N-dimethyl-2,2-diphenylacetamide);sulfane
CID 89402051
N,N-dimethyl-2,2-diphenylacetamide;ethane
CID 67314826
2-hydroxy-2-phenyl-N,N-dipropylacetamide
CID 54160997
N-[3-(diethylamino)propyl]-2,2-diphenyl-N-propan-2-ylacetamide
CID 3026496
N-(3-hydroxybutyl)-N-methyl-2,2-diphenylacetamide
CID 111695707
1-phenylethyl(propyl)carbamic acid
CID 57360234
2-(4-tert-butylphenyl)-N,N-diethyl-2-phenylacetamide
CID 102499696
2-(dipropylamino)-2-phenylacetohydrazide
CID 63569909
2-amino-3-phenyl-N,N-dipropylpropanamide;hydrochloride
CID 56831878
3-amino-N,N-diethyl-2-phenylpropanamide
CID 62876932
N-[2-[2-(diethylamino)ethyl-methylamino]-1-phenylethyl]-N-methyl-2,2-diphenylacetamide;hydrochloride
CID 54601257

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenyl-N-propylacetohydrazide;hydrochloride?
The IUPAC name of 2,2-diphenyl-N-propylacetohydrazide;hydrochloride (CID 139747660) is 2,2-diphenyl-N-propylacetohydrazide;hydrochloride.
What is the SMILES notation for 2,2-diphenyl-N-propylacetohydrazide;hydrochloride?
The canonical SMILES for 2,2-diphenyl-N-propylacetohydrazide;hydrochloride is CCCN(N)C(=O)C(c1ccccc1)c1ccccc1.Cl.
What is the InChIKey of 2,2-diphenyl-N-propylacetohydrazide;hydrochloride?
The InChIKey is HFAKKHMUTBMWFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O.ClH/c1-2-13-19(18)17(20)16(14-9-5-3-6-10-14)15-11-7-4-8-12-15;/h3-12,16H,2,13,18H2,1H3;1H.
What are the key properties of 2,2-diphenyl-N-propylacetohydrazide;hydrochloride?
2,2-diphenyl-N-propylacetohydrazide;hydrochloride has a molecular weight of 304.82 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenyl-N-propylacetohydrazide;hydrochloride is sourced from PubChem (CID 139747660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).