(2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine

C7H12IN3 — CID 88994635

IUPAC(2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine
SMILESC=C/C(I)=C\C(N)=C(/C)NN
InChIInChI=1S/C7H12IN3/c1-3-6(8)4-7(9)5(2)11-10/h3-4,11H,1,9-10H2,2H3/b6-4+,7-5-
InChIKeySRWDSDZSFONPNY-GUBXDBFYSA-N
MW265.10 g/mol
LogP1.14
Rot. Bonds3

About (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine

(2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine (PubChem CID 88994635) has the molecular formula C7H12IN3 and a molecular weight of 265.10 g/mol. Its IUPAC name is (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine.

Molecular Properties

Compound Name(2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine
PubChem CID88994635
Molecular FormulaC7H12IN3
Molecular Weight265.10 g/mol
Exact Mass265.01
IUPAC Name(2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine
SMILESC=C/C(I)=C\C(N)=C(/C)NN
InChIInChI=1S/C7H12IN3/c1-3-6(8)4-7(9)5(2)11-10/h3-4,11H,1,9-10H2,2H3/b6-4+,7-5-
InChIKeySRWDSDZSFONPNY-GUBXDBFYSA-N
XLogP1.14
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.10
LogP ≤ 51.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine with MolForge

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Related Compounds

ethane;(3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine;molecular hydrogen
CID 142384162
(Z)-2-hydrazinylprop-1-en-1-amine;molecular hydrogen
CID 144561883
ethane;ethene;(2Z)-penta-2,4-diene-2,3-diamine
CID 142059909
(Z)-2-hydrazinyl-4-methylpent-2-en-3-amine
CID 135233991
2-(1-aminoprop-2-enylidene)propanedinitrile
CID 18620400
(3E)-3-iodohexa-1,3,5-triene
CID 170744862
acetamide;prop-2-enamide
CID 158566181
3-methylpenta-2,4-dien-2-amine
CID 141358440
(3Z)-4-methoxy-5-methylhexa-1,3,5-trien-3-amine
CID 144610850
(3E,5Z)-3-methylocta-1,3,5-trien-4-amine
CID 88993026
(3E,5Z)-3-iodohepta-1,3,5-triene
CID 89257521
(4Z)-2-methyl-5-propan-2-ylhepta-2,4,6-trien-3-amine
CID 138459729

Frequently Asked Questions

What is the IUPAC name of (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine?
The IUPAC name of (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine (CID 88994635) is (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine.
What is the SMILES notation for (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine?
The canonical SMILES for (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine is C=C/C(I)=C\C(N)=C(/C)NN.
What is the InChIKey of (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine?
The InChIKey is SRWDSDZSFONPNY-GUBXDBFYSA-N. The full InChI is InChI=1S/C7H12IN3/c1-3-6(8)4-7(9)5(2)11-10/h3-4,11H,1,9-10H2,2H3/b6-4+,7-5-.
What are the key properties of (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine?
(2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine has a molecular weight of 265.10 g/mol, XLogP of 1.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z,4E)-2-hydrazinyl-5-iodohepta-2,4,6-trien-3-amine is sourced from PubChem (CID 88994635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).