(Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine

C10H20N2 — CID 138737694

IUPAC(Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine
SMILESC/C=C\CCNCC(N)/C=C\C
InChIInChI=1S/C10H20N2/c1-3-5-6-8-12-9-10(11)7-4-2/h3-5,7,10,12H,6,8-9,11H2,1-2H3/b5-3-,7-4-
InChIKeyJZKIMWWDYSHLGI-XDYPTIOJSA-N
MW168.28 g/mol
LogP1.45
Rot. Bonds6

About (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine

(Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine (PubChem CID 138737694) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine.

Molecular Properties

Compound Name(Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine
PubChem CID138737694
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name(Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine
SMILESC/C=C\CCNCC(N)/C=C\C
InChIInChI=1S/C10H20N2/c1-3-5-6-8-12-9-10(11)7-4-2/h3-5,7,10,12H,6,8-9,11H2,1-2H3/b5-3-,7-4-
InChIKeyJZKIMWWDYSHLGI-XDYPTIOJSA-N
XLogP1.45
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine?
The IUPAC name of (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine (CID 138737694) is (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine.
What is the SMILES notation for (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine?
The canonical SMILES for (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine is C/C=C\CCNCC(N)/C=C\C.
What is the InChIKey of (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine?
The InChIKey is JZKIMWWDYSHLGI-XDYPTIOJSA-N. The full InChI is InChI=1S/C10H20N2/c1-3-5-6-8-12-9-10(11)7-4-2/h3-5,7,10,12H,6,8-9,11H2,1-2H3/b5-3-,7-4-.
What are the key properties of (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine?
(Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine has a molecular weight of 168.28 g/mol, XLogP of 1.45, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-N-[(Z)-pent-3-enyl]pent-3-ene-1,2-diamine is sourced from PubChem (CID 138737694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).