4-imino-N,N,2-trimethylpent-2-en-3-amine

C8H16N2 — CID 134556658

IUPAC4-imino-N,N,2-trimethylpent-2-en-3-amine
SMILES[H]/N=C(\C)C(=C(C)C)N(C)C
InChIInChI=1S/C8H16N2/c1-6(2)8(7(3)9)10(4)5/h9H,1-5H3/b9-7+
InChIKeyKINZVROWQOETND-VQHVLOKHSA-N
MW140.23 g/mol
LogP1.88
Rot. Bonds2

About 4-imino-N,N,2-trimethylpent-2-en-3-amine

4-imino-N,N,2-trimethylpent-2-en-3-amine (PubChem CID 134556658) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 4-imino-N,N,2-trimethylpent-2-en-3-amine.

Molecular Properties

Compound Name4-imino-N,N,2-trimethylpent-2-en-3-amine
PubChem CID134556658
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name4-imino-N,N,2-trimethylpent-2-en-3-amine
SMILES[H]/N=C(\C)C(=C(C)C)N(C)C
InChIInChI=1S/C8H16N2/c1-6(2)8(7(3)9)10(4)5/h9H,1-5H3/b9-7+
InChIKeyKINZVROWQOETND-VQHVLOKHSA-N
XLogP1.88
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.88
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 4-imino-N,N,2-trimethylpent-2-en-3-amine?
The IUPAC name of 4-imino-N,N,2-trimethylpent-2-en-3-amine (CID 134556658) is 4-imino-N,N,2-trimethylpent-2-en-3-amine.
What is the SMILES notation for 4-imino-N,N,2-trimethylpent-2-en-3-amine?
The canonical SMILES for 4-imino-N,N,2-trimethylpent-2-en-3-amine is [H]/N=C(\C)C(=C(C)C)N(C)C.
What is the InChIKey of 4-imino-N,N,2-trimethylpent-2-en-3-amine?
The InChIKey is KINZVROWQOETND-VQHVLOKHSA-N. The full InChI is InChI=1S/C8H16N2/c1-6(2)8(7(3)9)10(4)5/h9H,1-5H3/b9-7+.
What are the key properties of 4-imino-N,N,2-trimethylpent-2-en-3-amine?
4-imino-N,N,2-trimethylpent-2-en-3-amine has a molecular weight of 140.23 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-imino-N,N,2-trimethylpent-2-en-3-amine is sourced from PubChem (CID 134556658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).