(Z)-3-methylimino-N-propylprop-1-en-1-amine

C7H14N2 — CID 89142723

IUPAC(Z)-3-methylimino-N-propylprop-1-en-1-amine
SMILESCCCN/C=C\C=N\C
InChIInChI=1S/C7H14N2/c1-3-5-9-7-4-6-8-2/h4,6-7,9H,3,5H2,1-2H3/b7-4-,8-6+
InChIKeyLPWMKTDIEFBJLV-ZJLRGQKUSA-N
MW126.20 g/mol
LogP1.20
Rot. Bonds4

About (Z)-3-methylimino-N-propylprop-1-en-1-amine

(Z)-3-methylimino-N-propylprop-1-en-1-amine (PubChem CID 89142723) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is (Z)-3-methylimino-N-propylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-methylimino-N-propylprop-1-en-1-amine
PubChem CID89142723
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name(Z)-3-methylimino-N-propylprop-1-en-1-amine
SMILESCCCN/C=C\C=N\C
InChIInChI=1S/C7H14N2/c1-3-5-9-7-4-6-8-2/h4,6-7,9H,3,5H2,1-2H3/b7-4-,8-6+
InChIKeyLPWMKTDIEFBJLV-ZJLRGQKUSA-N
XLogP1.20
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-3-methylimino-N-propylprop-1-en-1-amine?
The IUPAC name of (Z)-3-methylimino-N-propylprop-1-en-1-amine (CID 89142723) is (Z)-3-methylimino-N-propylprop-1-en-1-amine.
What is the SMILES notation for (Z)-3-methylimino-N-propylprop-1-en-1-amine?
The canonical SMILES for (Z)-3-methylimino-N-propylprop-1-en-1-amine is CCCN/C=C\C=N\C.
What is the InChIKey of (Z)-3-methylimino-N-propylprop-1-en-1-amine?
The InChIKey is LPWMKTDIEFBJLV-ZJLRGQKUSA-N. The full InChI is InChI=1S/C7H14N2/c1-3-5-9-7-4-6-8-2/h4,6-7,9H,3,5H2,1-2H3/b7-4-,8-6+.
What are the key properties of (Z)-3-methylimino-N-propylprop-1-en-1-amine?
(Z)-3-methylimino-N-propylprop-1-en-1-amine has a molecular weight of 126.20 g/mol, XLogP of 1.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-methylimino-N-propylprop-1-en-1-amine is sourced from PubChem (CID 89142723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).