2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine

C14H20ClN — CID 106866952

IUPAC2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
SMILESCNC(Cc1ccc(C)cc1Cl)C1CC1C
InChIInChI=1S/C14H20ClN/c1-9-4-5-11(13(15)6-9)8-14(16-3)12-7-10(12)2/h4-6,10,12,14,16H,7-8H2,1-3H3
InChIKeyHCADPGIHMZKJIT-UHFFFAOYSA-N
MW237.77 g/mol
LogP3.43
Rot. Bonds4

About 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine

2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine (PubChem CID 106866952) has the molecular formula C14H20ClN and a molecular weight of 237.77 g/mol. Its IUPAC name is 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine.

Molecular Properties

Compound Name2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
PubChem CID106866952
Molecular FormulaC14H20ClN
Molecular Weight237.77 g/mol
Exact Mass237.13
IUPAC Name2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
SMILESCNC(Cc1ccc(C)cc1Cl)C1CC1C
InChIInChI=1S/C14H20ClN/c1-9-4-5-11(13(15)6-9)8-14(16-3)12-7-10(12)2/h4-6,10,12,14,16H,7-8H2,1-3H3
InChIKeyHCADPGIHMZKJIT-UHFFFAOYSA-N
XLogP3.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.77
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chloro-4-methylphenyl)-1-cyclobutyl-N-methylethanamine
CID 106866254
2-(2-chloro-4-methylphenyl)-1-(3-ethyl-1,4-dithian-2-yl)-N-methylethanamine
CID 106868659
1-(2-chloro-4-methylphenyl)-N,4-dimethylpentan-2-amine
CID 106865986
2-(2-chloro-4-methylphenyl)-1-cyclopentylethanamine
CID 106866447
2-(4-bromophenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine
CID 61065850
2-(2-chloro-4-methylphenyl)-N-ethyl-1-(2-methyloxolan-3-yl)ethanamine
CID 106866070
2-(2-chloro-4-methylphenyl)-N-ethyl-1-(5-methyloxolan-3-yl)ethanamine
CID 106866403
1-(2-chloro-4-methylphenyl)-N,5-dimethylhexan-2-amine
CID 106866712
2-(2-chloro-4-methylphenyl)-1-cyclohexylethanamine
CID 106866830
1-(2-bicyclo[2.2.1]heptanyl)-3-(2-chloro-4-methylphenyl)-N-methylpropan-2-amine
CID 106867858
2-(2-chlorophenyl)-N-methyl-1-(2-methylcyclopentyl)ethanamine
CID 107179450
2-(2-chloro-4-methylphenyl)-1-(3,4-dichlorophenyl)-N-methylethanamine
CID 106866146

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine?
The IUPAC name of 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine (CID 106866952) is 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine.
What is the SMILES notation for 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine?
The canonical SMILES for 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine is CNC(Cc1ccc(C)cc1Cl)C1CC1C.
What is the InChIKey of 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine?
The InChIKey is HCADPGIHMZKJIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClN/c1-9-4-5-11(13(15)6-9)8-14(16-3)12-7-10(12)2/h4-6,10,12,14,16H,7-8H2,1-3H3.
What are the key properties of 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine?
2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine has a molecular weight of 237.77 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methylphenyl)-N-methyl-1-(2-methylcyclopropyl)ethanamine is sourced from PubChem (CID 106866952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).