1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine

C14H26N2 — CID 156743347

IUPAC1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine
SMILESCCC(CC1(C)C=CC(C)=CC1)N(C)NC
InChIInChI=1S/C14H26N2/c1-6-13(16(5)15-4)11-14(3)9-7-12(2)8-10-14/h7-9,13,15H,6,10-11H2,1-5H3
InChIKeyWHZHLYCBIVJRQD-UHFFFAOYSA-N
MW222.38 g/mol
LogP3.13
Rot. Bonds5

About 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine

1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine (PubChem CID 156743347) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine.

Molecular Properties

Compound Name1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine
PubChem CID156743347
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine
SMILESCCC(CC1(C)C=CC(C)=CC1)N(C)NC
InChIInChI=1S/C14H26N2/c1-6-13(16(5)15-4)11-14(3)9-7-12(2)8-10-14/h7-9,13,15H,6,10-11H2,1-5H3
InChIKeyWHZHLYCBIVJRQD-UHFFFAOYSA-N
XLogP3.13
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[2,2-Dimethyl-1-(5-methylcyclohexa-1,3-dien-1-yl)propyl]-1-methylhydrazine
CID 123200969
3-ethyl-N-methyl-2-azaspiro[4.4]non-7-en-2-amine
CID 123403764
(2Z)-6-ethyl-6-methyl-3-(methylaminomethyl)-4-[(Z)-prop-1-enyl]-2-propylidenecyclohex-3-en-1-amine
CID 134173718
1,2-Dimethyl-1-(5-methylspiro[2.5]oct-5-en-8-yl)hydrazine
CID 142964487
1-[(2Z)-7,7-dimethylcyclonon-2-en-1-yl]-1,2-dimethylhydrazine
CID 146259463
1-[1-(1,4-Dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine;ethane
CID 156743346
[(4S)-2,8-dimethyl-3-[(1Z)-3-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-4-yl]hydrazine
CID 169934420
2-butyl-5-tert-butyl-2H-pyridin-1-amine
CID 170118636
1-(2,2-Dimethylhydrazinyl)-4-(1-methylcyclohexa-2,4-dien-1-yl)butan-1-amine
CID 175195362
2-methyl-3-[(1Z)-2-methylbuta-1,3-dienyl]-8-azaspiro[4.5]dec-2-en-8-amine
CID 178161582
(2R)-3,3-dimethyl-2-[(4-methylcyclohepta-1,4,6-trien-1-yl)methyl]-4-methylidenepiperidin-1-amine
CID 141860441

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine?
The IUPAC name of 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine (CID 156743347) is 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine.
What is the SMILES notation for 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine?
The canonical SMILES for 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine is CCC(CC1(C)C=CC(C)=CC1)N(C)NC.
What is the InChIKey of 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine?
The InChIKey is WHZHLYCBIVJRQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-6-13(16(5)15-4)11-14(3)9-7-12(2)8-10-14/h7-9,13,15H,6,10-11H2,1-5H3.
What are the key properties of 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine?
1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine has a molecular weight of 222.38 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1,4-dimethylcyclohexa-2,4-dien-1-yl)butan-2-yl]-1,2-dimethylhydrazine is sourced from PubChem (CID 156743347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).