2-(2-chlorophenyl)ethenamine

C8H8ClN — CID 154223845

IUPAC2-(2-chlorophenyl)ethenamine
SMILESNC=Cc1ccccc1Cl
InChIInChI=1S/C8H8ClN/c9-8-4-2-1-3-7(8)5-6-10/h1-6H,10H2
InChIKeyRQPOBVDQPNPLPG-UHFFFAOYSA-N
MW153.61 g/mol
LogP2.27
Rot. Bonds1

About 2-(2-chlorophenyl)ethenamine

2-(2-chlorophenyl)ethenamine (PubChem CID 154223845) has the molecular formula C8H8ClN and a molecular weight of 153.61 g/mol. Its IUPAC name is 2-(2-chlorophenyl)ethenamine.

Molecular Properties

Compound Name2-(2-chlorophenyl)ethenamine
PubChem CID154223845
Molecular FormulaC8H8ClN
Molecular Weight153.61 g/mol
Exact Mass153.03
IUPAC Name2-(2-chlorophenyl)ethenamine
SMILESNC=Cc1ccccc1Cl
InChIInChI=1S/C8H8ClN/c9-8-4-2-1-3-7(8)5-6-10/h1-6H,10H2
InChIKeyRQPOBVDQPNPLPG-UHFFFAOYSA-N
XLogP2.27
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.61
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-chloro-2-[(1E,3E,5E)-6-(2-chlorophenyl)hexa-1,3,5-trienyl]benzene
CID 59205815
1-chloro-2-[(E)-prop-1-enyl]benzene;ethane
CID 144702462
4-[2-(2-chlorophenyl)ethenyl]aniline
CID 54098243
1-chloro-2-(2-phosphorosoethenyl)benzene
CID 175046650
(Z)-3-(2-chlorophenyl)prop-2-enenitrile
CID 11205957
1-chloro-2-[(E)-3,3,3-trifluoroprop-1-enyl]benzene
CID 12700740
CID 102035541
CID 102035541
(E)-3-(2-chlorophenyl)prop-2-enenitrile;hydron
CID 174388548
(E)-3-(2-chlorophenyl)prop-2-enoic acid
CID 700642
2-naphthalen-1-ylethenamine
CID 69243468
amino (E)-3-(2-chlorophenyl)prop-2-enoate
CID 10012953
1-chloro-2-[(1Z)-4-methylpenta-1,3-dienyl]benzene
CID 84820223

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)ethenamine?
The IUPAC name of 2-(2-chlorophenyl)ethenamine (CID 154223845) is 2-(2-chlorophenyl)ethenamine.
What is the SMILES notation for 2-(2-chlorophenyl)ethenamine?
The canonical SMILES for 2-(2-chlorophenyl)ethenamine is NC=Cc1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)ethenamine?
The InChIKey is RQPOBVDQPNPLPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN/c9-8-4-2-1-3-7(8)5-6-10/h1-6H,10H2.
What are the key properties of 2-(2-chlorophenyl)ethenamine?
2-(2-chlorophenyl)ethenamine has a molecular weight of 153.61 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)ethenamine is sourced from PubChem (CID 154223845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).