(Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine

C10H12IN — CID 156569404

IUPAC(Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine
SMILESC/C=C(\NC)c1ccccc1I
InChIInChI=1S/C10H12IN/c1-3-10(12-2)8-6-4-5-7-9(8)11/h3-7,12H,1-2H3/b10-3-
InChIKeyOPFJDUCLWZTNAD-KMKOMSMNSA-N
MW273.12 g/mol
LogP2.87
Rot. Bonds2

About (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine

(Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine (PubChem CID 156569404) has the molecular formula C10H12IN and a molecular weight of 273.12 g/mol. Its IUPAC name is (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine.

Molecular Properties

Compound Name(Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine
PubChem CID156569404
Molecular FormulaC10H12IN
Molecular Weight273.12 g/mol
Exact Mass273.00
IUPAC Name(Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine
SMILESC/C=C(\NC)c1ccccc1I
InChIInChI=1S/C10H12IN/c1-3-10(12-2)8-6-4-5-7-9(8)11/h3-7,12H,1-2H3/b10-3-
InChIKeyOPFJDUCLWZTNAD-KMKOMSMNSA-N
XLogP2.87
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.12
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

methyl 3-(2-iodophenyl)-3-oxopropanoate
CID 2759370
1-iodo-2-(1,2,2-triiodoethenyl)benzene
CID 139766406
methyl 2-iodobenzenecarbodithioate
CID 11737952
(2-iodophenyl)-phosphanylmethanone
CID 71171562
2-iodobenzamide
CID 160670857
3-iodo-N-methylnaphthalene-2-carboxamide
CID 133056320
[2-(methylcarbamoylamino)-2-oxoethyl] 2-iodobenzoate
CID 2509553
2-iodo-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]benzamide
CID 60776174
(2-iodobenzoyl)oxyboronic acid
CID 134957148
1-N',6-N'-bis(2-iodobenzoyl)hexanedihydrazide
CID 3752401
2-iodo-N-prop-2-ynylbenzamide
CID 18110013
(2-iodophenyl)-(4-methoxyphenyl)methanone
CID 43160499

Frequently Asked Questions

What is the IUPAC name of (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine?
The IUPAC name of (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine (CID 156569404) is (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine.
What is the SMILES notation for (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine?
The canonical SMILES for (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine is C/C=C(\NC)c1ccccc1I.
What is the InChIKey of (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine?
The InChIKey is OPFJDUCLWZTNAD-KMKOMSMNSA-N. The full InChI is InChI=1S/C10H12IN/c1-3-10(12-2)8-6-4-5-7-9(8)11/h3-7,12H,1-2H3/b10-3-.
What are the key properties of (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine?
(Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine has a molecular weight of 273.12 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-(2-iodophenyl)-N-methylprop-1-en-1-amine is sourced from PubChem (CID 156569404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).