(Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine

C12H24N2 — CID 134473501

IUPAC(Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine
SMILESCC/C(CN)=C(\CC)NC1CCCC1
InChIInChI=1S/C12H24N2/c1-3-10(9-13)12(4-2)14-11-7-5-6-8-11/h11,14H,3-9,13H2,1-2H3/b12-10-
InChIKeyFYLBTEVQCGOYNL-BENRWUELSA-N
MW196.34 g/mol
LogP2.55
Rot. Bonds5

About (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine

(Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine (PubChem CID 134473501) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine.

Molecular Properties

Compound Name(Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine
PubChem CID134473501
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name(Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine
SMILESCC/C(CN)=C(\CC)NC1CCCC1
InChIInChI=1S/C12H24N2/c1-3-10(9-13)12(4-2)14-11-7-5-6-8-11/h11,14H,3-9,13H2,1-2H3/b12-10-
InChIKeyFYLBTEVQCGOYNL-BENRWUELSA-N
XLogP2.55
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine?
The IUPAC name of (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine (CID 134473501) is (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine.
What is the SMILES notation for (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine?
The canonical SMILES for (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine is CC/C(CN)=C(\CC)NC1CCCC1.
What is the InChIKey of (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine?
The InChIKey is FYLBTEVQCGOYNL-BENRWUELSA-N. The full InChI is InChI=1S/C12H24N2/c1-3-10(9-13)12(4-2)14-11-7-5-6-8-11/h11,14H,3-9,13H2,1-2H3/b12-10-.
What are the key properties of (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine?
(Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine has a molecular weight of 196.34 g/mol, XLogP of 2.55, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-N-cyclopentyl-2-ethylpent-2-ene-1,3-diamine is sourced from PubChem (CID 134473501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).