N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine

C10H18N2 — CID 123142247

IUPACN-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine
SMILESCNCC/N=C1/C=CC(C)CC1
InChIInChI=1S/C10H18N2/c1-9-3-5-10(6-4-9)12-8-7-11-2/h3,5,9,11H,4,6-8H2,1-2H3/b12-10-
InChIKeyCYHOBDSVCQKPME-BENRWUELSA-N
MW166.27 g/mol
LogP1.63
Rot. Bonds3

About N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine

N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine (PubChem CID 123142247) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine
PubChem CID123142247
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine
SMILESCNCC/N=C1/C=CC(C)CC1
InChIInChI=1S/C10H18N2/c1-9-3-5-10(6-4-9)12-8-7-11-2/h3,5,9,11H,4,6-8H2,1-2H3/b12-10-
InChIKeyCYHOBDSVCQKPME-BENRWUELSA-N
XLogP1.63
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(4-fluorocyclohex-2-en-1-ylidene)amino]-N-methylethanamine
CID 123615088
Cyclopropyl-(3-methyl-2,3-dihydropyridin-6-yl)methanamine
CID 91269933
(4Z,7Z)-6-ethylimino-N,2-dimethyl-7-propan-2-ylnona-4,7-dien-1-amine
CID 123139515
2-[(6-Methylcyclohex-2-en-1-ylidene)amino]ethanamine
CID 123211734
(4-Propyliminocyclohex-2-en-1-yl)methanamine
CID 123339384
2-(cyclohex-2-en-1-ylideneamino)-N-methylethanamine
CID 123408588
2-[(4-Propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine
CID 123495440
(4-Butyliminocyclohex-2-en-1-yl)methanamine
CID 123602996
(4-Methyliminocyclohex-2-en-1-yl)methanamine
CID 123703590
2-[(4-Methylcyclohex-2-en-1-ylidene)amino]ethanamine
CID 123719177
N-ethyl-N'-[(4-iminocyclohex-2-en-1-yl)methyl]ethane-1,2-diamine
CID 123781711
1-(4-Methyldeca-5,8-dien-2-ylideneamino)ethanamine
CID 123847360

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine?
The IUPAC name of N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine (CID 123142247) is N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine.
What is the SMILES notation for N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine?
The canonical SMILES for N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine is CNCC/N=C1/C=CC(C)CC1.
What is the InChIKey of N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine?
The InChIKey is CYHOBDSVCQKPME-BENRWUELSA-N. The full InChI is InChI=1S/C10H18N2/c1-9-3-5-10(6-4-9)12-8-7-11-2/h3,5,9,11H,4,6-8H2,1-2H3/b12-10-.
What are the key properties of N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine?
N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine has a molecular weight of 166.27 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine is sourced from PubChem (CID 123142247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).