4-imino-5,6-dimethylcyclohex-2-en-1-amine

C8H14N2 — CID 123143860

IUPAC4-imino-5,6-dimethylcyclohex-2-en-1-amine
SMILES[H]/N=C1\C=CC(N)C(C)C1C
InChIInChI=1S/C8H14N2/c1-5-6(2)8(10)4-3-7(5)9/h3-7,10H,9H2,1-2H3/b10-8+
InChIKeyBTMYICGOHJFCCT-CSKARUKUSA-N
MW138.21 g/mol
LogP1.18
Rot. Bonds

About 4-imino-5,6-dimethylcyclohex-2-en-1-amine

4-imino-5,6-dimethylcyclohex-2-en-1-amine (PubChem CID 123143860) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 4-imino-5,6-dimethylcyclohex-2-en-1-amine.

Molecular Properties

Compound Name4-imino-5,6-dimethylcyclohex-2-en-1-amine
PubChem CID123143860
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name4-imino-5,6-dimethylcyclohex-2-en-1-amine
SMILES[H]/N=C1\C=CC(N)C(C)C1C
InChIInChI=1S/C8H14N2/c1-5-6(2)8(10)4-3-7(5)9/h3-7,10H,9H2,1-2H3/b10-8+
InChIKeyBTMYICGOHJFCCT-CSKARUKUSA-N
XLogP1.18
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 ≤ 51.18
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

5-Fluoro-2-imino-6-methylcyclohex-3-en-1-amine
CID 91117964
5,6-Dimethylcyclohex-3-ene-1,2-diamine
CID 69547500
2-Imino-2-(6-methylcyclohex-3-en-1-yl)ethanamine
CID 89074104
2-Imino-1-(6-methylcyclohexa-1,3-dien-1-yl)ethanamine
CID 89153800
2-imino-2-[(6S)-6-methylcyclohex-3-en-1-yl]ethanamine
CID 89153885
5,6-Dimethylcyclohex-2-en-1-amine
CID 89394775
1-(5-Imino-6-methylcyclohex-3-en-1-yl)ethanamine
CID 123217836
2-(2-Iminocyclopent-3-en-1-yl)cyclopenta-2,4-dien-1-amine
CID 123264569
(4-Propyliminocyclohex-2-en-1-yl)methanamine
CID 123339384
(4-Iminocyclohex-2-en-1-yl)methanediamine
CID 123494371
4-Imino-2,5-dimethylcyclohex-2-en-1-amine
CID 123524045
(4-Butyliminocyclohex-2-en-1-yl)methanamine
CID 123602996

Frequently Asked Questions

What is the IUPAC name of 4-imino-5,6-dimethylcyclohex-2-en-1-amine?
The IUPAC name of 4-imino-5,6-dimethylcyclohex-2-en-1-amine (CID 123143860) is 4-imino-5,6-dimethylcyclohex-2-en-1-amine.
What is the SMILES notation for 4-imino-5,6-dimethylcyclohex-2-en-1-amine?
The canonical SMILES for 4-imino-5,6-dimethylcyclohex-2-en-1-amine is [H]/N=C1\C=CC(N)C(C)C1C.
What is the InChIKey of 4-imino-5,6-dimethylcyclohex-2-en-1-amine?
The InChIKey is BTMYICGOHJFCCT-CSKARUKUSA-N. The full InChI is InChI=1S/C8H14N2/c1-5-6(2)8(10)4-3-7(5)9/h3-7,10H,9H2,1-2H3/b10-8+.
What are the key properties of 4-imino-5,6-dimethylcyclohex-2-en-1-amine?
4-imino-5,6-dimethylcyclohex-2-en-1-amine has a molecular weight of 138.21 g/mol, XLogP of 1.18, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imino-5,6-dimethylcyclohex-2-en-1-amine is sourced from PubChem (CID 123143860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).