2-imino-3,4-dimethylcyclohex-3-en-1-amine

C8H14N2 — CID 91179392

IUPAC2-imino-3,4-dimethylcyclohex-3-en-1-amine
SMILES[H]/N=C1\C(C)=C(C)CCC1N
InChIInChI=1S/C8H14N2/c1-5-3-4-7(9)8(10)6(5)2/h7,10H,3-4,9H2,1-2H3/b10-8+
InChIKeyDFCTUHLXITXGOD-CSKARUKUSA-N
MW138.21 g/mol
LogP1.46
Rot. Bonds

About 2-imino-3,4-dimethylcyclohex-3-en-1-amine

2-imino-3,4-dimethylcyclohex-3-en-1-amine (PubChem CID 91179392) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-imino-3,4-dimethylcyclohex-3-en-1-amine.

Molecular Properties

Compound Name2-imino-3,4-dimethylcyclohex-3-en-1-amine
PubChem CID91179392
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2-imino-3,4-dimethylcyclohex-3-en-1-amine
SMILES[H]/N=C1\C(C)=C(C)CCC1N
InChIInChI=1S/C8H14N2/c1-5-3-4-7(9)8(10)6(5)2/h7,10H,3-4,9H2,1-2H3/b10-8+
InChIKeyDFCTUHLXITXGOD-CSKARUKUSA-N
XLogP1.46
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

3,4-Diethyl-2-iminocyclooct-3-en-1-amine
CID 90798400
2-Imino-4-methylcyclohex-3-en-1-amine
CID 91018476
3,4-Diethyl-2-iminocyclohex-3-en-1-amine
CID 91108254
2-Imino-3,4-dimethylcyclooct-3-en-1-amine
CID 91118223
3-Cycloundecylidene-2-iminocycloundecan-1-amine
CID 91271732
2-Imino-3,4-dimethylcyclopent-3-en-1-amine
CID 91382058
3,4-Diethyl-2-iminocyclopent-3-en-1-amine
CID 91549426
1-(6-Iminocyclohexen-1-yl)ethanamine
CID 123374353
2-[(2,3-Dimethylcyclohex-2-en-1-ylidene)amino]ethanamine
CID 123597011
1-(3-Iminocyclohexen-1-yl)ethanamine
CID 123703939
(4Z)-4-ethylidene-3-iminodecan-5-amine
CID 132036830
2-Propanimidoylcyclohexen-1-amine
CID 142125554

Frequently Asked Questions

What is the IUPAC name of 2-imino-3,4-dimethylcyclohex-3-en-1-amine?
The IUPAC name of 2-imino-3,4-dimethylcyclohex-3-en-1-amine (CID 91179392) is 2-imino-3,4-dimethylcyclohex-3-en-1-amine.
What is the SMILES notation for 2-imino-3,4-dimethylcyclohex-3-en-1-amine?
The canonical SMILES for 2-imino-3,4-dimethylcyclohex-3-en-1-amine is [H]/N=C1\C(C)=C(C)CCC1N.
What is the InChIKey of 2-imino-3,4-dimethylcyclohex-3-en-1-amine?
The InChIKey is DFCTUHLXITXGOD-CSKARUKUSA-N. The full InChI is InChI=1S/C8H14N2/c1-5-3-4-7(9)8(10)6(5)2/h7,10H,3-4,9H2,1-2H3/b10-8+.
What are the key properties of 2-imino-3,4-dimethylcyclohex-3-en-1-amine?
2-imino-3,4-dimethylcyclohex-3-en-1-amine has a molecular weight of 138.21 g/mol, XLogP of 1.46, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imino-3,4-dimethylcyclohex-3-en-1-amine is sourced from PubChem (CID 91179392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).