(Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine

C9H18N2 — CID 123972243

IUPAC(Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine
SMILES[H]/N=C(/C=C\N(C)C)C(C)CC
InChIInChI=1S/C9H18N2/c1-5-8(2)9(10)6-7-11(3)4/h6-8,10H,5H2,1-4H3/b7-6-,10-9-
InChIKeyVOGPPRYZMGXOFZ-HZJYTTRNSA-N
MW154.26 g/mol
LogP2.13
Rot. Bonds4

About (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine

(Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine (PubChem CID 123972243) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine
PubChem CID123972243
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine
SMILES[H]/N=C(/C=C\N(C)C)C(C)CC
InChIInChI=1S/C9H18N2/c1-5-8(2)9(10)6-7-11(3)4/h6-8,10H,5H2,1-4H3/b7-6-,10-9-
InChIKeyVOGPPRYZMGXOFZ-HZJYTTRNSA-N
XLogP2.13
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine?
The IUPAC name of (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine (CID 123972243) is (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine.
What is the SMILES notation for (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine?
The canonical SMILES for (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine is [H]/N=C(/C=C\N(C)C)C(C)CC.
What is the InChIKey of (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine?
The InChIKey is VOGPPRYZMGXOFZ-HZJYTTRNSA-N. The full InChI is InChI=1S/C9H18N2/c1-5-8(2)9(10)6-7-11(3)4/h6-8,10H,5H2,1-4H3/b7-6-,10-9-.
What are the key properties of (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine?
(Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine has a molecular weight of 154.26 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-imino-N,N,4-trimethylhex-1-en-1-amine is sourced from PubChem (CID 123972243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).