1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine

C10H14ClNO — CID 84775565

IUPAC1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine
SMILESCNCc1c(Cl)cc(C)cc1OC
InChIInChI=1S/C10H14ClNO/c1-7-4-9(11)8(6-12-2)10(5-7)13-3/h4-5,12H,6H2,1-3H3
InChIKeyUDWDDGBWYPRRMR-UHFFFAOYSA-N
MW199.68 g/mol
LogP2.38
Rot. Bonds3

About 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine

1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine (PubChem CID 84775565) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine
PubChem CID84775565
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC Name1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine
SMILESCNCc1c(Cl)cc(C)cc1OC
InChIInChI=1S/C10H14ClNO/c1-7-4-9(11)8(6-12-2)10(5-7)13-3/h4-5,12H,6H2,1-3H3
InChIKeyUDWDDGBWYPRRMR-UHFFFAOYSA-N
XLogP2.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine
CID 84769264
1-(2-chloro-6-methoxy-4-methylphenyl)propan-2-one
CID 84782491
N'-[(2-methoxy-4,6-dimethylphenyl)methyl]-N-methylethane-1,2-diamine
CID 115195883
N-[(2,6-dimethoxy-4-methylphenyl)methyl]propan-2-amine
CID 145435829
1-(5-chloro-2-fluoro-4-methoxyphenyl)-N-methylmethanamine
CID 84671954
(2,6-dimethoxy-4-methylphenyl)methanamine
CID 58024962
1-(2,4-dichloro-6-methylphenyl)-N-methylmethanamine
CID 18721638
1-(2-chloro-3-fluoro-5,6-dimethoxyphenyl)-N-methylmethanamine
CID 84697228
4-chloro-3,5-dimethoxy-2-(methylaminomethyl)phenol
CID 84795051
N'-[(5-chloro-4-methoxy-2-methylphenyl)methyl]-N-methylmethanediamine
CID 89373836
3-fluoro-5-methoxy-4-(methylaminomethyl)phenol
CID 84769612
2-(2,2-dimethylpropyl)-1,3-dimethoxy-5-methylbenzene
CID 59743812

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine (CID 84775565) is 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine is CNCc1c(Cl)cc(C)cc1OC.
What is the InChIKey of 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine?
The InChIKey is UDWDDGBWYPRRMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNO/c1-7-4-9(11)8(6-12-2)10(5-7)13-3/h4-5,12H,6H2,1-3H3.
What are the key properties of 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine?
1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine has a molecular weight of 199.68 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine is sourced from PubChem (CID 84775565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).