(E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine

C8H17N3 — CID 138702842

IUPAC(E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine
SMILESC=C/C(=C\CNNC)C(C)N
InChIInChI=1S/C8H17N3/c1-4-8(7(2)9)5-6-11-10-3/h4-5,7,10-11H,1,6,9H2,2-3H3/b8-5+
InChIKeyAFFLCGISENCRSG-VMPITWQZSA-N
MW155.24 g/mol
LogP0.17
Rot. Bonds5

About (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine

(E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine (PubChem CID 138702842) has the molecular formula C8H17N3 and a molecular weight of 155.24 g/mol. Its IUPAC name is (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine.

Molecular Properties

Compound Name(E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine
PubChem CID138702842
Molecular FormulaC8H17N3
Molecular Weight155.24 g/mol
Exact Mass155.14
IUPAC Name(E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine
SMILESC=C/C(=C\CNNC)C(C)N
InChIInChI=1S/C8H17N3/c1-4-8(7(2)9)5-6-11-10-3/h4-5,7,10-11H,1,6,9H2,2-3H3/b8-5+
InChIKeyAFFLCGISENCRSG-VMPITWQZSA-N
XLogP0.17
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(2R,3E)-3-ethenylhexa-3,5-dien-2-amine
CID 142221873
(2S,3E)-3-ethenylhexa-3,5-dien-2-amine
CID 126549063
(2Z)-N,3-di(propan-2-yl)penta-2,4-dien-1-amine
CID 166807119
(E,2S,3S)-2-amino-4-ethenylhex-4-en-3-ol;ethene
CID 142354278
(2S,3R)-3-aminopent-4-en-2-ol
CID 131375579
(3E)-3-[(1,3-dimethyldiaziridin-3-yl)methylidene]pent-4-en-2-amine
CID 138702992
(2R,3E)-3-ethenyl-1-(methylamino)hexa-3,5-dien-2-ol
CID 177168631
(2S,3E)-3-ethenyl-N,2-dimethylhexa-3,5-dien-1-amine
CID 154678805
(3E)-3-ethenyl-2-N-methylhexa-3,5-diene-1,2-diamine
CID 143109843
amino-(prop-2-enylamino)methanol
CID 126627121
ethene;(E)-4-ethenyl-N-methylhex-4-en-3-amine
CID 142152607
(2E,4Z)-N,2-dimethyl-5-propan-2-ylhepta-2,4,6-trien-1-amine
CID 143114260

Frequently Asked Questions

What is the IUPAC name of (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine?
The IUPAC name of (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine (CID 138702842) is (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine.
What is the SMILES notation for (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine?
The canonical SMILES for (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine is C=C/C(=C\CNNC)C(C)N.
What is the InChIKey of (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine?
The InChIKey is AFFLCGISENCRSG-VMPITWQZSA-N. The full InChI is InChI=1S/C8H17N3/c1-4-8(7(2)9)5-6-11-10-3/h4-5,7,10-11H,1,6,9H2,2-3H3/b8-5+.
What are the key properties of (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine?
(E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine has a molecular weight of 155.24 g/mol, XLogP of 0.17, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-ethenyl-5-(2-methylhydrazinyl)pent-3-en-2-amine is sourced from PubChem (CID 138702842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).