(Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine

C7H10IN3 — CID 118674848

IUPAC(Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine
SMILESC=N/C(=C/I)N(/C=C\C)N=C
InChIInChI=1S/C7H10IN3/c1-4-5-11(10-3)7(6-8)9-2/h4-6H,2-3H2,1H3/b5-4-,7-6-
InChIKeyGGZHASNYHLFGEW-RZSVFLSASA-N
MW263.08 g/mol
LogP2.37
Rot. Bonds4

About (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine

(Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine (PubChem CID 118674848) has the molecular formula C7H10IN3 and a molecular weight of 263.08 g/mol. Its IUPAC name is (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine
PubChem CID118674848
Molecular FormulaC7H10IN3
Molecular Weight263.08 g/mol
Exact Mass262.99
IUPAC Name(Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine
SMILESC=N/C(=C/I)N(/C=C\C)N=C
InChIInChI=1S/C7H10IN3/c1-4-5-11(10-3)7(6-8)9-2/h4-6H,2-3H2,1H3/b5-4-,7-6-
InChIKeyGGZHASNYHLFGEW-RZSVFLSASA-N
XLogP2.37
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.08
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine?
The IUPAC name of (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine (CID 118674848) is (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine.
What is the SMILES notation for (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine?
The canonical SMILES for (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine is C=N/C(=C/I)N(/C=C\C)N=C.
What is the InChIKey of (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine?
The InChIKey is GGZHASNYHLFGEW-RZSVFLSASA-N. The full InChI is InChI=1S/C7H10IN3/c1-4-5-11(10-3)7(6-8)9-2/h4-6H,2-3H2,1H3/b5-4-,7-6-.
What are the key properties of (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine?
(Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine has a molecular weight of 263.08 g/mol, XLogP of 2.37, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(Z)-2-iodo-1-(methylideneamino)ethenyl]-N-(methylideneamino)prop-1-en-1-amine is sourced from PubChem (CID 118674848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).