(Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine

C9H16N2 — CID 170104067

IUPAC(Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine
SMILESC=C/N=C(/C=C\N)C(C)(C)C
InChIInChI=1S/C9H16N2/c1-5-11-8(6-7-10)9(2,3)4/h5-7H,1,10H2,2-4H3/b7-6-,11-8-
InChIKeyLGPMAKNWQAMFCC-NJMVCRMVSA-N
MW152.24 g/mol
LogP2.09
Rot. Bonds2

About (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine

(Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine (PubChem CID 170104067) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine.

Molecular Properties

Compound Name(Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine
PubChem CID170104067
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine
SMILESC=C/N=C(/C=C\N)C(C)(C)C
InChIInChI=1S/C9H16N2/c1-5-11-8(6-7-10)9(2,3)4/h5-7H,1,10H2,2-4H3/b7-6-,11-8-
InChIKeyLGPMAKNWQAMFCC-NJMVCRMVSA-N
XLogP2.09
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.09
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-ethenylimino-4,4-dimethylpent-1-en-1-amine?
The IUPAC name of (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine (CID 170104067) is (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine.
What is the SMILES notation for (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine?
The canonical SMILES for (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine is C=C/N=C(/C=C\N)C(C)(C)C.
What is the InChIKey of (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine?
The InChIKey is LGPMAKNWQAMFCC-NJMVCRMVSA-N. The full InChI is InChI=1S/C9H16N2/c1-5-11-8(6-7-10)9(2,3)4/h5-7H,1,10H2,2-4H3/b7-6-,11-8-.
What are the key properties of (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine?
(Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine has a molecular weight of 152.24 g/mol, XLogP of 2.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-ethenylimino-4,4-dimethylpent-1-en-1-amine is sourced from PubChem (CID 170104067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).