N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine

C10H18N2 — CID 123472772

IUPACN-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine
SMILESC/N=C1\CC(CCNC)C=C1C
InChIInChI=1S/C10H18N2/c1-8-6-9(4-5-11-2)7-10(8)12-3/h6,9,11H,4-5,7H2,1-3H3/b12-10+
InChIKeyUDXIPRONSXTCFM-ZRDIBKRKSA-N
MW166.27 g/mol
LogP1.63
Rot. Bonds3

About N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine

N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine (PubChem CID 123472772) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine
PubChem CID123472772
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC NameN-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine
SMILESC/N=C1\CC(CCNC)C=C1C
InChIInChI=1S/C10H18N2/c1-8-6-9(4-5-11-2)7-10(8)12-3/h6,9,11H,4-5,7H2,1-3H3/b12-10+
InChIKeyUDXIPRONSXTCFM-ZRDIBKRKSA-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': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

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4-(5-methyl-2H-pyrrol-3-yl)piperidine
CID 58578256
4-methyl-6-[[(3R)-pyrrolidin-3-yl]methyl]-2,3-dihydropyridin-2-amine
CID 89037011
3-but-2-enyl-7-imino-N,6-dimethyloct-3-en-1-amine
CID 90691312
N-methyl-1-[6-[(Z)-3-methylidene-6-methyliminohept-4-en-2-yl]cyclohexa-1,5-dien-1-yl]ethanamine
CID 91045781
2-[2-(N-ethyl-C-methylcarbonimidoyl)cyclopentylidene]ethanamine
CID 91180465
2-[2-(C,N-dimethylcarbonimidoyl)cyclopentylidene]ethanamine
CID 91468924
1-N-ethyl-6-imino-8-methylnon-7-ene-1,5-diamine
CID 91539250
N'-[(5-cyclobutyl-2H-pyrrol-4-yl)methyl]-N'-methylethane-1,2-diamine
CID 117660968
N'-methyl-N'-[[5-(2-methylpropyl)-2H-pyrrol-4-yl]methyl]ethane-1,2-diamine
CID 121442676
(4Z,7Z)-6-ethylimino-N,2-dimethyl-7-propan-2-ylnona-4,7-dien-1-amine
CID 123139515

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine?
The IUPAC name of N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine (CID 123472772) is N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine?
The canonical SMILES for N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine is C/N=C1\CC(CCNC)C=C1C.
What is the InChIKey of N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine?
The InChIKey is UDXIPRONSXTCFM-ZRDIBKRKSA-N. The full InChI is InChI=1S/C10H18N2/c1-8-6-9(4-5-11-2)7-10(8)12-3/h6,9,11H,4-5,7H2,1-3H3/b12-10+.
What are the key properties of N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine?
N-methyl-2-(3-methyl-4-methyliminocyclopent-2-en-1-yl)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-(3-methyl-4-methyliminocyclopent-2-en-1-yl)ethanamine is sourced from PubChem (CID 123472772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).