(Z)-2-[amino(butyl)amino]hex-1-en-1-amine

C10H23N3 — CID 126702764

IUPAC(Z)-2-[amino(butyl)amino]hex-1-en-1-amine
SMILESCCCC/C(=C/N)N(N)CCCC
InChIInChI=1S/C10H23N3/c1-3-5-7-10(9-11)13(12)8-6-4-2/h9H,3-8,11-12H2,1-2H3/b10-9-
InChIKeyCWGHZZLPHJTCFJ-KTKRTIGZSA-N
MW185.31 g/mol
LogP1.95
Rot. Bonds7

About (Z)-2-[amino(butyl)amino]hex-1-en-1-amine

(Z)-2-[amino(butyl)amino]hex-1-en-1-amine (PubChem CID 126702764) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is (Z)-2-[amino(butyl)amino]hex-1-en-1-amine.

Molecular Properties

Compound Name(Z)-2-[amino(butyl)amino]hex-1-en-1-amine
PubChem CID126702764
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Name(Z)-2-[amino(butyl)amino]hex-1-en-1-amine
SMILESCCCC/C(=C/N)N(N)CCCC
InChIInChI=1S/C10H23N3/c1-3-5-7-10(9-11)13(12)8-6-4-2/h9H,3-8,11-12H2,1-2H3/b10-9-
InChIKeyCWGHZZLPHJTCFJ-KTKRTIGZSA-N
XLogP1.95
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-[amino(butyl)amino]hex-1-en-1-amine?
The IUPAC name of (Z)-2-[amino(butyl)amino]hex-1-en-1-amine (CID 126702764) is (Z)-2-[amino(butyl)amino]hex-1-en-1-amine.
What is the SMILES notation for (Z)-2-[amino(butyl)amino]hex-1-en-1-amine?
The canonical SMILES for (Z)-2-[amino(butyl)amino]hex-1-en-1-amine is CCCC/C(=C/N)N(N)CCCC.
What is the InChIKey of (Z)-2-[amino(butyl)amino]hex-1-en-1-amine?
The InChIKey is CWGHZZLPHJTCFJ-KTKRTIGZSA-N. The full InChI is InChI=1S/C10H23N3/c1-3-5-7-10(9-11)13(12)8-6-4-2/h9H,3-8,11-12H2,1-2H3/b10-9-.
What are the key properties of (Z)-2-[amino(butyl)amino]hex-1-en-1-amine?
(Z)-2-[amino(butyl)amino]hex-1-en-1-amine has a molecular weight of 185.31 g/mol, XLogP of 1.95, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-[amino(butyl)amino]hex-1-en-1-amine is sourced from PubChem (CID 126702764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).