1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine

C15H27N3O2 — CID 105240484

IUPAC1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine
SMILESCCC(C)(C(NN)c1ccc(OC)c(OC)c1)N(C)C
InChIInChI=1S/C15H27N3O2/c1-7-15(2,18(3)4)14(17-16)11-8-9-12(19-5)13(10-11)20-6/h8-10,14,17H,7,16H2,1-6H3
InChIKeyCFXZUYMBFCKEKV-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.94
Rot. Bonds7

About 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine

1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine (PubChem CID 105240484) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine.

Molecular Properties

Compound Name1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine
PubChem CID105240484
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine
SMILESCCC(C)(C(NN)c1ccc(OC)c(OC)c1)N(C)C
InChIInChI=1S/C15H27N3O2/c1-7-15(2,18(3)4)14(17-16)11-8-9-12(19-5)13(10-11)20-6/h8-10,14,17H,7,16H2,1-6H3
InChIKeyCFXZUYMBFCKEKV-UHFFFAOYSA-N
XLogP1.94
TPSA59.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

[1-(3,4-dimethoxyphenyl)-2-methoxy-2-methylbutyl]hydrazine
CID 105274332
1-(4-chloro-3-methoxyphenyl)-1-N,2-N,2-N,2-tetramethylbutane-1,2-diamine
CID 79700151
1-hydrazinyl-N,N,2-trimethyl-1-thiophen-3-ylbutan-2-amine
CID 105240466
1-(3,4-dimethoxyphenyl)propan-1-amine;hydrochloride
CID 22669212
1-(3,4-dimethoxyphenyl)-2-(2-methylbutan-2-yloxy)ethanamine
CID 43127780
1-(3,4-dimethoxyphenyl)-1-N,2-N,2-trimethylpropane-1,2-diamine
CID 116954007
[1-(3,4-dimethoxyphenyl)-2-ethoxyethyl]hydrazine
CID 105192155
1-(4-chloro-3-methoxyphenyl)-1-N,2-diethyl-2-N,2-N-dimethylbutane-1,2-diamine
CID 79698267
1-(3,4-difluorophenyl)-1-N,2-N,2-N,2-tetramethylbutane-1,2-diamine
CID 79063885
N,N-diethyl-1-(4-fluoro-3-methylphenyl)-1-hydrazinyl-2-methylbutan-2-amine
CID 105240807
1-(2,6-dimethoxyphenyl)-2-N,2-N,2-trimethylbutane-1,2-diamine
CID 116810559
1-(3,4-dimethoxyphenyl)-2,2-dimethylbutane-1,4-diamine
CID 116934449

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine?
The IUPAC name of 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine (CID 105240484) is 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine.
What is the SMILES notation for 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine?
The canonical SMILES for 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine is CCC(C)(C(NN)c1ccc(OC)c(OC)c1)N(C)C.
What is the InChIKey of 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine?
The InChIKey is CFXZUYMBFCKEKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-7-15(2,18(3)4)14(17-16)11-8-9-12(19-5)13(10-11)20-6/h8-10,14,17H,7,16H2,1-6H3.
What are the key properties of 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine?
1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine has a molecular weight of 281.40 g/mol, XLogP of 1.94, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dimethoxyphenyl)-1-hydrazinyl-N,N,2-trimethylbutan-2-amine is sourced from PubChem (CID 105240484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).