ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine

C10H17N — CID 142131627

IUPACethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine
SMILESC=C.C=CC(/C=C(\C)N)=C\C
InChIInChI=1S/C8H13N.C2H4/c1-4-8(5-2)6-7(3)9;1-2/h4-6H,1,9H2,2-3H3;1-2H2/b7-6+,8-5+;
InChIKeyCORNQJKAXMERKE-SGVYSVLESA-N
MW151.25 g/mol
LogP2.78
Rot. Bonds2

About ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine

ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine (PubChem CID 142131627) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine.

Molecular Properties

Compound Nameethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine
PubChem CID142131627
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Nameethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine
SMILESC=C.C=CC(/C=C(\C)N)=C\C
InChIInChI=1S/C8H13N.C2H4/c1-4-8(5-2)6-7(3)9;1-2/h4-6H,1,9H2,2-3H3;1-2H2/b7-6+,8-5+;
InChIKeyCORNQJKAXMERKE-SGVYSVLESA-N
XLogP2.78
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(3E,5Z)-5-ethenylhepta-1,3,5-triene-2,3-diamine
CID 163766280
(2Z,4Z)-4-ethenylhexa-2,4-diene-1,2-diamine
CID 146360770
(3Z,4E)-3-ethylidene-5,6,6-trimethylhepta-1,4-diene
CID 153392507
(2Z,4Z)-4-methylhexa-2,4-dien-2-amine
CID 126728104
(Z)-but-2-en-2-amine;ethane;ethenamine
CID 143379680
(5Z)-2-amino-6-methylocta-2,5,7-trien-4-one
CID 163530566
(3Z,5Z)-5-ethenyl-2-methylhepta-1,3,5-triene
CID 142327747
(2E,5Z)-5-methyl-4-methylidenehepta-2,5-dien-2-amine
CID 169247779
ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine
CID 142059909
(3Z)-penta-1,3-diene-2,4-diamine;propane
CID 144731148
acetamide;prop-2-enamide
CID 158566181
2,6-diaminohepta-2,5-dien-4-one
CID 74377910

Frequently Asked Questions

What is the IUPAC name of ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine?
The IUPAC name of ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine (CID 142131627) is ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine.
What is the SMILES notation for ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine?
The canonical SMILES for ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine is C=C.C=CC(/C=C(\C)N)=C\C.
What is the InChIKey of ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine?
The InChIKey is CORNQJKAXMERKE-SGVYSVLESA-N. The full InChI is InChI=1S/C8H13N.C2H4/c1-4-8(5-2)6-7(3)9;1-2/h4-6H,1,9H2,2-3H3;1-2H2/b7-6+,8-5+;.
What are the key properties of ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine?
ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine has a molecular weight of 151.25 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;(2E,4E)-4-ethenylhexa-2,4-dien-2-amine is sourced from PubChem (CID 142131627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).