1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine

C11H23N3 — CID 163933433

IUPAC1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine
SMILESCNCCN(C)C1C(NC)=CCC1C
InChIInChI=1S/C11H23N3/c1-9-5-6-10(13-3)11(9)14(4)8-7-12-2/h6,9,11-13H,5,7-8H2,1-4H3
InChIKeyRKQXWSAHKPZZCY-UHFFFAOYSA-N
MW197.33 g/mol
LogP0.65
Rot. Bonds5

About 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine

1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine (PubChem CID 163933433) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine
PubChem CID163933433
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC Name1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine
SMILESCNCCN(C)C1C(NC)=CCC1C
InChIInChI=1S/C11H23N3/c1-9-5-6-10(13-3)11(9)14(4)8-7-12-2/h6,9,11-13H,5,7-8H2,1-4H3
InChIKeyRKQXWSAHKPZZCY-UHFFFAOYSA-N
XLogP0.65
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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(E)-3-N-ethylhex-2-ene-3,4-diamine
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Frequently Asked Questions

What is the IUPAC name of 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine?
The IUPAC name of 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine (CID 163933433) is 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine.
What is the SMILES notation for 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine?
The canonical SMILES for 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine is CNCCN(C)C1C(NC)=CCC1C.
What is the InChIKey of 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine?
The InChIKey is RKQXWSAHKPZZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-9-5-6-10(13-3)11(9)14(4)8-7-12-2/h6,9,11-13H,5,7-8H2,1-4H3.
What are the key properties of 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine?
1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine has a molecular weight of 197.33 g/mol, XLogP of 0.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N,5-trimethyl-1-N-[2-(methylamino)ethyl]cyclopent-2-ene-1,2-diamine is sourced from PubChem (CID 163933433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).