2-ethenyl-4-methyliminopentan-1-amine

C8H16N2 — CID 145468051

IUPAC2-ethenyl-4-methyliminopentan-1-amine
SMILESC=CC(CN)C/C(C)=N/C
InChIInChI=1S/C8H16N2/c1-4-8(6-9)5-7(2)10-3/h4,8H,1,5-6,9H2,2-3H3/b10-7+
InChIKeyOBZLEUOJLVHGSS-JXMROGBWSA-N
MW140.23 g/mol
LogP1.23
Rot. Bonds4

About 2-ethenyl-4-methyliminopentan-1-amine

2-ethenyl-4-methyliminopentan-1-amine (PubChem CID 145468051) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 2-ethenyl-4-methyliminopentan-1-amine.

Molecular Properties

Compound Name2-ethenyl-4-methyliminopentan-1-amine
PubChem CID145468051
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name2-ethenyl-4-methyliminopentan-1-amine
SMILESC=CC(CN)C/C(C)=N/C
InChIInChI=1S/C8H16N2/c1-4-8(6-9)5-7(2)10-3/h4,8H,1,5-6,9H2,2-3H3/b10-7+
InChIKeyOBZLEUOJLVHGSS-JXMROGBWSA-N
XLogP1.23
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-Imino-6-methylhept-1-en-4-amine
CID 89093635
3-Imino-5-methyloct-7-en-2-amine
CID 90277713
(Z)-3-ethyl-4-methyliminonon-5-en-1-amine
CID 91420602
(4Z)-4-[(butan-2-ylideneamino)methylidene]hex-5-en-1-amine
CID 123142909
(4-Propyliminocyclohex-2-en-1-yl)methanamine
CID 123339384
7-(1-Amino-3-methylbutyl)iminooct-5-en-1-amine
CID 123446462
(4-Butyliminocyclohex-2-en-1-yl)methanamine
CID 123602996
(4-Methyliminocyclohex-2-en-1-yl)methanamine
CID 123703590
2-N-but-3-enyl-3-methylhexane-2,4-diimine
CID 123819837
1-(4-Methyldeca-5,8-dien-2-ylideneamino)ethanamine
CID 123847360
2-N-(5-methylhept-6-en-2-yl)pentane-2,3-diimine
CID 123857206
3-Imino-5-methylhept-6-en-2-amine
CID 124011593

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-4-methyliminopentan-1-amine?
The IUPAC name of 2-ethenyl-4-methyliminopentan-1-amine (CID 145468051) is 2-ethenyl-4-methyliminopentan-1-amine.
What is the SMILES notation for 2-ethenyl-4-methyliminopentan-1-amine?
The canonical SMILES for 2-ethenyl-4-methyliminopentan-1-amine is C=CC(CN)C/C(C)=N/C.
What is the InChIKey of 2-ethenyl-4-methyliminopentan-1-amine?
The InChIKey is OBZLEUOJLVHGSS-JXMROGBWSA-N. The full InChI is InChI=1S/C8H16N2/c1-4-8(6-9)5-7(2)10-3/h4,8H,1,5-6,9H2,2-3H3/b10-7+.
What are the key properties of 2-ethenyl-4-methyliminopentan-1-amine?
2-ethenyl-4-methyliminopentan-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-4-methyliminopentan-1-amine is sourced from PubChem (CID 145468051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).