(E)-dec-1-ene-1,2-diamine

C10H22N2 — CID 87327630

IUPAC(E)-dec-1-ene-1,2-diamine
SMILESCCCCCCCC/C(N)=C\N
InChIInChI=1S/C10H22N2/c1-2-3-4-5-6-7-8-10(12)9-11/h9H,2-8,11-12H2,1H3/b10-9+
InChIKeyWVBRSJVYTAPLEX-MDZDMXLPSA-N
MW170.30 g/mol
LogP2.50
Rot. Bonds7

About (E)-dec-1-ene-1,2-diamine

(E)-dec-1-ene-1,2-diamine (PubChem CID 87327630) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is (E)-dec-1-ene-1,2-diamine.

Molecular Properties

Compound Name(E)-dec-1-ene-1,2-diamine
PubChem CID87327630
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name(E)-dec-1-ene-1,2-diamine
SMILESCCCCCCCC/C(N)=C\N
InChIInChI=1S/C10H22N2/c1-2-3-4-5-6-7-8-10(12)9-11/h9H,2-8,11-12H2,1H3/b10-9+
InChIKeyWVBRSJVYTAPLEX-MDZDMXLPSA-N
XLogP2.50
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-dec-1-ene-1,2-diamine?
The IUPAC name of (E)-dec-1-ene-1,2-diamine (CID 87327630) is (E)-dec-1-ene-1,2-diamine.
What is the SMILES notation for (E)-dec-1-ene-1,2-diamine?
The canonical SMILES for (E)-dec-1-ene-1,2-diamine is CCCCCCCC/C(N)=C\N.
What is the InChIKey of (E)-dec-1-ene-1,2-diamine?
The InChIKey is WVBRSJVYTAPLEX-MDZDMXLPSA-N. The full InChI is InChI=1S/C10H22N2/c1-2-3-4-5-6-7-8-10(12)9-11/h9H,2-8,11-12H2,1H3/b10-9+.
What are the key properties of (E)-dec-1-ene-1,2-diamine?
(E)-dec-1-ene-1,2-diamine has a molecular weight of 170.30 g/mol, XLogP of 2.50, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-dec-1-ene-1,2-diamine is sourced from PubChem (CID 87327630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).