1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine

C10H14ClN — CID 84769264

IUPAC1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine
SMILESCNCc1c(C)cc(C)cc1Cl
InChIInChI=1S/C10H14ClN/c1-7-4-8(2)9(6-12-3)10(11)5-7/h4-5,12H,6H2,1-3H3
InChIKeyHJCJTRZZACYHHD-UHFFFAOYSA-N
MW183.68 g/mol
LogP2.68
Rot. Bonds2

About 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine

1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine (PubChem CID 84769264) has the molecular formula C10H14ClN and a molecular weight of 183.68 g/mol. Its IUPAC name is 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine
PubChem CID84769264
Molecular FormulaC10H14ClN
Molecular Weight183.68 g/mol
Exact Mass183.08
IUPAC Name1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine
SMILESCNCc1c(C)cc(C)cc1Cl
InChIInChI=1S/C10H14ClN/c1-7-4-8(2)9(6-12-3)10(11)5-7/h4-5,12H,6H2,1-3H3
InChIKeyHJCJTRZZACYHHD-UHFFFAOYSA-N
XLogP2.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.68
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,4-dichloro-6-methylphenyl)-N-methylmethanamine
CID 18721638
1-(2-chloro-6-methoxy-4-methylphenyl)-N-methylmethanamine
CID 84775565
1-chloro-2-(iodomethyl)-3,5-dimethylbenzene
CID 170736542
1-chloro-2-(cyclopropylmethyl)-3,5-dimethylbenzene
CID 143995722
2-(2-chloro-4,6-dimethylphenyl)acetic acid
CID 59141966
1-(6-chloro-2,3-dimethylphenyl)-N-methylmethanamine
CID 84659371
1-[4-(4-chlorophenyl)-2,6-dimethylphenyl]-N-methylmethanamine;hydrochloride
CID 172876680
2-chloro-4-[(2,4,6-trimethylphenyl)methylamino]benzonitrile
CID 43348060
2-(2,6-dichloro-4-methylphenyl)acetonitrile
CID 119013215
1-[1-(2-chloro-4,6-dimethylphenyl)aziridin-2-yl]-N-methylmethanamine
CID 117010202
1-(2,6-dichlorophenyl)-N-methylmethanamine;ethane
CID 142839804
N-(2-chloro-4,6-dimethylphenyl)-2-(methylamino)acetamide
CID 83537406

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine (CID 84769264) is 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine is CNCc1c(C)cc(C)cc1Cl.
What is the InChIKey of 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine?
The InChIKey is HJCJTRZZACYHHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClN/c1-7-4-8(2)9(6-12-3)10(11)5-7/h4-5,12H,6H2,1-3H3.
What are the key properties of 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine?
1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine has a molecular weight of 183.68 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4,6-dimethylphenyl)-N-methylmethanamine is sourced from PubChem (CID 84769264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).