[1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine

C12H20N2O2 — CID 105245974

IUPAC[1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine
SMILESCOC(OC)C(Cc1cccc(C)c1)NN
InChIInChI=1S/C12H20N2O2/c1-9-5-4-6-10(7-9)8-11(14-13)12(15-2)16-3/h4-7,11-12,14H,8,13H2,1-3H3
InChIKeyKJDSJXWPVBHFGK-UHFFFAOYSA-N
MW224.30 g/mol
LogP0.99
Rot. Bonds6

About [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine

[1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine (PubChem CID 105245974) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine
PubChem CID105245974
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name[1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine
SMILESCOC(OC)C(Cc1cccc(C)c1)NN
InChIInChI=1S/C12H20N2O2/c1-9-5-4-6-10(7-9)8-11(14-13)12(15-2)16-3/h4-7,11-12,14H,8,13H2,1-3H3
InChIKeyKJDSJXWPVBHFGK-UHFFFAOYSA-N
XLogP0.99
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine 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

[1-(3,5-dimethylphenyl)-3-(3-methylphenyl)propan-2-yl]hydrazine
CID 105208894
[3-methoxy-3-methyl-1-(3-methylphenyl)butan-2-yl]hydrazine
CID 105245324
[1,1-dimethoxy-3-(2-methoxy-5-methylphenyl)propan-2-yl]hydrazine
CID 105246103
[3-(4-iodophenyl)-1,1-dimethoxypropan-2-yl]hydrazine
CID 105246005
N-ethyl-3-methoxy-1-(3-methylphenyl)pentan-2-amine
CID 116715829
[1,1,1-trifluoro-3-(3-methylphenyl)propan-2-yl]hydrazine
CID 105215650
4-[2-hydrazinyl-3-(3-methylphenyl)propyl]pyridin-2-amine
CID 105208933
[1-(3-chlorophenyl)-3-methoxybutan-2-yl]hydrazine
CID 105247122
[5,5-dimethyl-1-(3-methylphenyl)hexan-2-yl]hydrazine
CID 105208965
3-hydrazinyl-N,N-dimethyl-4-(3-methylphenyl)butan-1-amine
CID 105259182
1,1-difluoro-N-methyl-3-(3-methylphenyl)propan-2-amine
CID 103759785
[1-(2,5-dichlorophenyl)-3-(3-methylphenyl)propan-2-yl]hydrazine
CID 105209040

Frequently Asked Questions

What is the IUPAC name of [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine?
The IUPAC name of [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine (CID 105245974) is [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine.
What is the SMILES notation for [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine?
The canonical SMILES for [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine is COC(OC)C(Cc1cccc(C)c1)NN.
What is the InChIKey of [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine?
The InChIKey is KJDSJXWPVBHFGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-9-5-4-6-10(7-9)8-11(14-13)12(15-2)16-3/h4-7,11-12,14H,8,13H2,1-3H3.
What are the key properties of [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine?
[1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine has a molecular weight of 224.30 g/mol, XLogP of 0.99, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1,1-dimethoxy-3-(3-methylphenyl)propan-2-yl]hydrazine is sourced from PubChem (CID 105245974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).