2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine

C10H18N2 — CID 123597011

IUPAC2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine
SMILESCC1=C(C)/C(=N/CCN)CCC1
InChIInChI=1S/C10H18N2/c1-8-4-3-5-10(9(8)2)12-7-6-11/h3-7,11H2,1-2H3/b12-10+
InChIKeyVFJCELYLGYBEAT-ZRDIBKRKSA-N
MW166.27 g/mol
LogP1.91
Rot. Bonds2

About 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine

2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine (PubChem CID 123597011) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine.

Molecular Properties

Compound Name2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine
PubChem CID123597011
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine
SMILESCC1=C(C)/C(=N/CCN)CCC1
InChIInChI=1S/C10H18N2/c1-8-4-3-5-10(9(8)2)12-7-6-11/h3-7,11H2,1-2H3/b12-10+
InChIKeyVFJCELYLGYBEAT-ZRDIBKRKSA-N
XLogP1.91
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(C,N-dimethylcarbonimidoyl)cyclohexen-1-amine
CID 66908657
3,4-Diethyl-2-iminocyclohex-3-en-1-amine
CID 91108254
2-Imino-3,4-dimethylcyclohex-3-en-1-amine
CID 91179392
[6-(3-Methylideneoctyl)-2,3-dihydropyridin-2-yl]methanamine
CID 91229717
2-(4,5-Dimethylhept-4-en-3-ylideneamino)ethanamine
CID 124027387
(E)-N,3-dimethyl-4-methyliminonon-2-en-2-amine
CID 134567900
(2-Methyl-6-methyliminocyclohexen-1-yl)methanamine
CID 164153452
(1R)-4-ethanimidoyl-3-methylcyclohex-3-en-1-amine
CID 167030960
4-Ethanimidoyl-3-methylcyclohex-3-en-1-amine
CID 167030981
1-(2-Methyliminocycloundecylidene)ethanamine
CID 174083180
2-[(3-Methylcyclohex-2-en-1-ylidene)amino]ethanamine
CID 45091777
N'-ethyl-N'-[4-(2-methylcyclohexen-1-yl)-4-methyliminobutyl]ethane-1,2-diamine
CID 141879972

Frequently Asked Questions

What is the IUPAC name of 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine?
The IUPAC name of 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine (CID 123597011) is 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine.
What is the SMILES notation for 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine?
The canonical SMILES for 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine is CC1=C(C)/C(=N/CCN)CCC1.
What is the InChIKey of 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine?
The InChIKey is VFJCELYLGYBEAT-ZRDIBKRKSA-N. The full InChI is InChI=1S/C10H18N2/c1-8-4-3-5-10(9(8)2)12-7-6-11/h3-7,11H2,1-2H3/b12-10+.
What are the key properties of 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine?
2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine has a molecular weight of 166.27 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2,3-dimethylcyclohex-2-en-1-ylidene)amino]ethanamine is sourced from PubChem (CID 123597011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).