(E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine

C9H16N2 — CID 88939004

IUPAC(E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine
SMILESC=C/N=C(/C=C/N(C)C)CC
InChIInChI=1S/C9H16N2/c1-5-9(10-6-2)7-8-11(3)4/h6-8H,2,5H2,1,3-4H3/b8-7+,10-9+
InChIKeyMUSYZFLFGSJWPC-XBLVEGMJSA-N
MW152.24 g/mol
LogP2.06
Rot. Bonds4

About (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine

(E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine (PubChem CID 88939004) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine.

Molecular Properties

Compound Name(E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine
PubChem CID88939004
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine
SMILESC=C/N=C(/C=C/N(C)C)CC
InChIInChI=1S/C9H16N2/c1-5-9(10-6-2)7-8-11(3)4/h6-8H,2,5H2,1,3-4H3/b8-7+,10-9+
InChIKeyMUSYZFLFGSJWPC-XBLVEGMJSA-N
XLogP2.06
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.06
H-Bond Donors ≤ 50
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 (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine?
The IUPAC name of (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine (CID 88939004) is (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine.
What is the SMILES notation for (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine?
The canonical SMILES for (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine is C=C/N=C(/C=C/N(C)C)CC.
What is the InChIKey of (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine?
The InChIKey is MUSYZFLFGSJWPC-XBLVEGMJSA-N. The full InChI is InChI=1S/C9H16N2/c1-5-9(10-6-2)7-8-11(3)4/h6-8H,2,5H2,1,3-4H3/b8-7+,10-9+.
What are the key properties of (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine?
(E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine has a molecular weight of 152.24 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-ethenylimino-N,N-dimethylpent-1-en-1-amine is sourced from PubChem (CID 88939004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).