2-chloro-6-[2-(methylamino)propyl]phenol

C10H14ClNO — CID 84733707

IUPAC2-chloro-6-[2-(methylamino)propyl]phenol
SMILESCNC(C)Cc1cccc(Cl)c1O
InChIInChI=1S/C10H14ClNO/c1-7(12-2)6-8-4-3-5-9(11)10(8)13/h3-5,7,12-13H,6H2,1-2H3
InChIKeyRWUSJEMBTYSVLG-UHFFFAOYSA-N
MW199.68 g/mol
LogP2.20
Rot. Bonds3

About 2-chloro-6-[2-(methylamino)propyl]phenol

2-chloro-6-[2-(methylamino)propyl]phenol (PubChem CID 84733707) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is 2-chloro-6-[2-(methylamino)propyl]phenol.

Molecular Properties

Compound Name2-chloro-6-[2-(methylamino)propyl]phenol
PubChem CID84733707
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC Name2-chloro-6-[2-(methylamino)propyl]phenol
SMILESCNC(C)Cc1cccc(Cl)c1O
InChIInChI=1S/C10H14ClNO/c1-7(12-2)6-8-4-3-5-9(11)10(8)13/h3-5,7,12-13H,6H2,1-2H3
InChIKeyRWUSJEMBTYSVLG-UHFFFAOYSA-N
XLogP2.20
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-6-[2-(methylamino)propyl]phenol
CID 14265623
2-methoxy-6-[2-(methylamino)propyl]phenol
CID 68884486
2-chloro-6-(methylaminomethyl)phenol;hydrochloride
CID 135396200
2-chloro-6-[(2-hydroxypropylamino)methyl]phenol
CID 112553929
1-[2-(2,2-difluoroethyl)phenyl]-N-methylpropan-2-amine
CID 84723521
(2R)-N-methyl-1-naphthalen-1-ylpropan-2-amine
CID 142942326
4-(2,3-dichlorophenyl)-N-methylbutan-2-amine
CID 64503767
2-chloro-6-[(2-hydroxyphenyl)methyl]phenol
CID 22151945
2-chloro-6-[(4-methylsulfanylbutan-2-ylamino)methyl]phenol
CID 115907627
2-chloro-6-[[[(1S)-1-(2-chlorophenyl)ethyl]amino]methyl]phenol
CID 103924012
2-[[1-(2-chlorophenyl)propan-2-ylamino]methyl]-6-fluorophenol
CID 115951107
2-[(3-chloro-2-hydroxyphenyl)methylamino]propanamide
CID 112568714

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-[2-(methylamino)propyl]phenol?
The IUPAC name of 2-chloro-6-[2-(methylamino)propyl]phenol (CID 84733707) is 2-chloro-6-[2-(methylamino)propyl]phenol.
What is the SMILES notation for 2-chloro-6-[2-(methylamino)propyl]phenol?
The canonical SMILES for 2-chloro-6-[2-(methylamino)propyl]phenol is CNC(C)Cc1cccc(Cl)c1O.
What is the InChIKey of 2-chloro-6-[2-(methylamino)propyl]phenol?
The InChIKey is RWUSJEMBTYSVLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNO/c1-7(12-2)6-8-4-3-5-9(11)10(8)13/h3-5,7,12-13H,6H2,1-2H3.
What are the key properties of 2-chloro-6-[2-(methylamino)propyl]phenol?
2-chloro-6-[2-(methylamino)propyl]phenol has a molecular weight of 199.68 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[2-(methylamino)propyl]phenol is sourced from PubChem (CID 84733707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).