2,4-dichloro-6-[2-(methylamino)ethyl]phenol

C9H11Cl2NO — CID 83889183

IUPAC2,4-dichloro-6-[2-(methylamino)ethyl]phenol
SMILESCNCCc1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C9H11Cl2NO/c1-12-3-2-6-4-7(10)5-8(11)9(6)13/h4-5,12-13H,2-3H2,1H3
InChIKeyBSERNZAFIMYFPO-UHFFFAOYSA-N
MW220.10 g/mol
LogP2.46
Rot. Bonds3

About 2,4-dichloro-6-[2-(methylamino)ethyl]phenol

2,4-dichloro-6-[2-(methylamino)ethyl]phenol (PubChem CID 83889183) has the molecular formula C9H11Cl2NO and a molecular weight of 220.10 g/mol. Its IUPAC name is 2,4-dichloro-6-[2-(methylamino)ethyl]phenol.

Molecular Properties

Compound Name2,4-dichloro-6-[2-(methylamino)ethyl]phenol
PubChem CID83889183
Molecular FormulaC9H11Cl2NO
Molecular Weight220.10 g/mol
Exact Mass219.02
IUPAC Name2,4-dichloro-6-[2-(methylamino)ethyl]phenol
SMILESCNCCc1cc(Cl)cc(Cl)c1O
InChIInChI=1S/C9H11Cl2NO/c1-12-3-2-6-4-7(10)5-8(11)9(6)13/h4-5,12-13H,2-3H2,1H3
InChIKeyBSERNZAFIMYFPO-UHFFFAOYSA-N
XLogP2.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.10
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(Z)-but-2-enyl]-4,6-dichlorophenol
CID 92532445
3-(3,5-dichloro-2-hydroxyphenyl)propanoic acid
CID 54270247
2,4-dichloro-6-(3-methylpentyl)phenol
CID 143655603
acetic acid;2,4-dichloro-6-[[2-[(3,5-dichloro-2-hydroxyphenyl)methylamino]ethylamino]methyl]phenol
CID 70616535
2-(3,5-dichloro-2-hydroxyphenyl)acetic acid
CID 70463293
2,4-dichloro-6-[(ethoxyamino)methyl]phenol
CID 82710474
N-[2-[(3,5-dichloro-2-hydroxyphenyl)methylamino]ethyl]acetamide
CID 28684903
2,4-dichloro-6-[[(1-methylcyclopropyl)amino]methyl]phenol
CID 115635121
2,5-dichloro-3-[[2-[(3,5-dichloro-2-hydroxyphenyl)methylamino]ethylamino]methyl]phenol
CID 134097048
4-fluoro-2-methyl-6-[2-(methylamino)ethyl]phenol
CID 83876237
N-methyl-4-(2,4,6-trichlorophenyl)butan-1-amine
CID 105350377
butyl-[(3,5-dichloro-2-hydroxyphenyl)methyl]-methylazanium
CID 7014283

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-6-[2-(methylamino)ethyl]phenol?
The IUPAC name of 2,4-dichloro-6-[2-(methylamino)ethyl]phenol (CID 83889183) is 2,4-dichloro-6-[2-(methylamino)ethyl]phenol.
What is the SMILES notation for 2,4-dichloro-6-[2-(methylamino)ethyl]phenol?
The canonical SMILES for 2,4-dichloro-6-[2-(methylamino)ethyl]phenol is CNCCc1cc(Cl)cc(Cl)c1O.
What is the InChIKey of 2,4-dichloro-6-[2-(methylamino)ethyl]phenol?
The InChIKey is BSERNZAFIMYFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2NO/c1-12-3-2-6-4-7(10)5-8(11)9(6)13/h4-5,12-13H,2-3H2,1H3.
What are the key properties of 2,4-dichloro-6-[2-(methylamino)ethyl]phenol?
2,4-dichloro-6-[2-(methylamino)ethyl]phenol has a molecular weight of 220.10 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-6-[2-(methylamino)ethyl]phenol is sourced from PubChem (CID 83889183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).