N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine

C11H18N2 — CID 144537859

IUPACN,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine
SMILESC=C(C)/C=N/C1=C(C)CCC1NC
InChIInChI=1S/C11H18N2/c1-8(2)7-13-11-9(3)5-6-10(11)12-4/h7,10,12H,1,5-6H2,2-4H3/b13-7+
InChIKeyHKRYQGDNEPMQOT-NTUHNPAUSA-N
MW178.28 g/mol
LogP2.29
Rot. Bonds3

About N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine

N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine (PubChem CID 144537859) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine.

Molecular Properties

Compound NameN,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine
PubChem CID144537859
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC NameN,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine
SMILESC=C(C)/C=N/C1=C(C)CCC1NC
InChIInChI=1S/C11H18N2/c1-8(2)7-13-11-9(3)5-6-10(11)12-4/h7,10,12H,1,5-6H2,2-4H3/b13-7+
InChIKeyHKRYQGDNEPMQOT-NTUHNPAUSA-N
XLogP2.29
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine?
The IUPAC name of N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine (CID 144537859) is N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine.
What is the SMILES notation for N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine?
The canonical SMILES for N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine is C=C(C)/C=N/C1=C(C)CCC1NC.
What is the InChIKey of N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine?
The InChIKey is HKRYQGDNEPMQOT-NTUHNPAUSA-N. The full InChI is InChI=1S/C11H18N2/c1-8(2)7-13-11-9(3)5-6-10(11)12-4/h7,10,12H,1,5-6H2,2-4H3/b13-7+.
What are the key properties of N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine?
N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine has a molecular weight of 178.28 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-2-(2-methylprop-2-enylideneamino)cyclopent-2-en-1-amine is sourced from PubChem (CID 144537859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).