N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine

C10H20N2 — CID 116674153

IUPACN'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)CCC1C=CCC1
InChIInChI=1S/C10H20N2/c1-12(9-7-11)8-6-10-4-2-3-5-10/h2,4,10H,3,5-9,11H2,1H3
InChIKeyZEMYTUQTYXZWON-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.23
Rot. Bonds5

About N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine

N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine (PubChem CID 116674153) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine
PubChem CID116674153
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC NameN'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine
SMILESCN(CCN)CCC1C=CCC1
InChIInChI=1S/C10H20N2/c1-12(9-7-11)8-6-10-4-2-3-5-10/h2,4,10H,3,5-9,11H2,1H3
InChIKeyZEMYTUQTYXZWON-UHFFFAOYSA-N
XLogP1.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine (CID 116674153) is N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine is CN(CCN)CCC1C=CCC1.
What is the InChIKey of N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine?
The InChIKey is ZEMYTUQTYXZWON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-12(9-7-11)8-6-10-4-2-3-5-10/h2,4,10H,3,5-9,11H2,1H3.
What are the key properties of N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine?
N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine has a molecular weight of 168.28 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-cyclopent-2-en-1-ylethyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 116674153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).