N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine

C17H31N3 — CID 105240787

IUPACN,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine
SMILESCCc1cccc(C(NN)C(C)(CC)N(CC)CC)c1
InChIInChI=1S/C17H31N3/c1-6-14-11-10-12-15(13-14)16(19-18)17(5,7-2)20(8-3)9-4/h10-13,16,19H,6-9,18H2,1-5H3
InChIKeyPHZOOTVPYUSHMZ-UHFFFAOYSA-N
MW277.46 g/mol
LogP3.26
Rot. Bonds8

About N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine

N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine (PubChem CID 105240787) has the molecular formula C17H31N3 and a molecular weight of 277.46 g/mol. Its IUPAC name is N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine.

Molecular Properties

Compound NameN,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine
PubChem CID105240787
Molecular FormulaC17H31N3
Molecular Weight277.46 g/mol
Exact Mass277.25
IUPAC NameN,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine
SMILESCCc1cccc(C(NN)C(C)(CC)N(CC)CC)c1
InChIInChI=1S/C17H31N3/c1-6-14-11-10-12-15(13-14)16(19-18)17(5,7-2)20(8-3)9-4/h10-13,16,19H,6-9,18H2,1-5H3
InChIKeyPHZOOTVPYUSHMZ-UHFFFAOYSA-N
XLogP3.26
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.46
LogP ≤ 53.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine 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

2-N,2-N-diethyl-1-N,2-dimethyl-1-(3-propylphenyl)butane-1,2-diamine
CID 116544674
N,N-diethyl-1-(4-fluoro-3-methylphenyl)-1-hydrazinyl-2-methylbutan-2-amine
CID 105240807
[2-chloro-1-(3-ethylphenyl)-2,2-difluoroethyl]hydrazine
CID 105265335
2-N,2-N-diethyl-1-(3-methoxyphenyl)-1-N,2-dimethylbutane-1,2-diamine
CID 79068906
N,N-diethyl-1-hydrazinyl-2-methyl-1-(2,4,5-trimethylphenyl)butan-2-amine
CID 105240936
1-(3-chlorophenyl)-2-N,2-N-diethyl-2-methyl-1-N-propylbutane-1,2-diamine
CID 79058576
1-(2-ethoxyphenyl)-N,N-diethyl-1-hydrazinyl-2-methylbutan-2-amine
CID 105240781
1-(2,5-difluorophenyl)-N,N-diethyl-1-hydrazinyl-2-methylbutan-2-amine
CID 105240869
2-N,2-N-diethyl-1-N,2-dimethyl-1-(3-propylphenyl)propane-1,2-diamine
CID 116544650
N,N-diethyl-1-(2-fluoro-5-methylphenyl)-1-hydrazinyl-2-methylbutan-2-amine
CID 105240808
N,N-diethyl-4-hydrazinyl-3-methyl-7-phenylheptan-3-amine
CID 105240772
[2-cyclopropyl-1-(3-ethylphenyl)ethyl]hydrazine
CID 105253991

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine?
The IUPAC name of N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine (CID 105240787) is N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine.
What is the SMILES notation for N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine?
The canonical SMILES for N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine is CCc1cccc(C(NN)C(C)(CC)N(CC)CC)c1.
What is the InChIKey of N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine?
The InChIKey is PHZOOTVPYUSHMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N3/c1-6-14-11-10-12-15(13-14)16(19-18)17(5,7-2)20(8-3)9-4/h10-13,16,19H,6-9,18H2,1-5H3.
What are the key properties of N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine?
N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine has a molecular weight of 277.46 g/mol, XLogP of 3.26, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-(3-ethylphenyl)-1-hydrazinyl-2-methylbutan-2-amine is sourced from PubChem (CID 105240787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).