(Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine

C7H12N2 — CID 89075506

IUPAC(Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine
SMILESCC(C)=C/N=C/C=C\N
InChIInChI=1S/C7H12N2/c1-7(2)6-9-5-3-4-8/h3-6H,8H2,1-2H3/b4-3-,9-5+
InChIKeyDCOMMZTZFVHBOP-XBURUKCPSA-N
MW124.19 g/mol
LogP1.45
Rot. Bonds2

About (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine

(Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine (PubChem CID 89075506) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine
PubChem CID89075506
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC Name(Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine
SMILESCC(C)=C/N=C/C=C\N
InChIInChI=1S/C7H12N2/c1-7(2)6-9-5-3-4-8/h3-6H,8H2,1-2H3/b4-3-,9-5+
InChIKeyDCOMMZTZFVHBOP-XBURUKCPSA-N
XLogP1.45
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.45
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-(2-methylprop-1-enylimino)prop-1-en-1-amine?
The IUPAC name of (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine (CID 89075506) is (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine.
What is the SMILES notation for (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine?
The canonical SMILES for (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine is CC(C)=C/N=C/C=C\N.
What is the InChIKey of (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine?
The InChIKey is DCOMMZTZFVHBOP-XBURUKCPSA-N. The full InChI is InChI=1S/C7H12N2/c1-7(2)6-9-5-3-4-8/h3-6H,8H2,1-2H3/b4-3-,9-5+.
What are the key properties of (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine?
(Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine has a molecular weight of 124.19 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(2-methylprop-1-enylimino)prop-1-en-1-amine is sourced from PubChem (CID 89075506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).