2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine

C16H24ClNO — CID 55036427

IUPAC2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine
SMILESCNCC(OC1CCCCC1C)c1cccc(Cl)c1
InChIInChI=1S/C16H24ClNO/c1-12-6-3-4-9-15(12)19-16(11-18-2)13-7-5-8-14(17)10-13/h5,7-8,10,12,15-16,18H,3-4,6,9,11H2,1-2H3
InChIKeyKTUOVMJRVCDUAD-UHFFFAOYSA-N
MW281.83 g/mol
LogP4.20
Rot. Bonds5

About 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine

2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine (PubChem CID 55036427) has the molecular formula C16H24ClNO and a molecular weight of 281.83 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine
PubChem CID55036427
Molecular FormulaC16H24ClNO
Molecular Weight281.83 g/mol
Exact Mass281.15
IUPAC Name2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine
SMILESCNCC(OC1CCCCC1C)c1cccc(Cl)c1
InChIInChI=1S/C16H24ClNO/c1-12-6-3-4-9-15(12)19-16(11-18-2)13-7-5-8-14(17)10-13/h5,7-8,10,12,15-16,18H,3-4,6,9,11H2,1-2H3
InChIKeyKTUOVMJRVCDUAD-UHFFFAOYSA-N
XLogP4.20
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.83
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-methoxyphenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine
CID 62107386
2-(3-chlorophenyl)-2-(cyclopropylmethoxy)-N-methylethanamine
CID 62107327
N-[2-(2-methylcyclohexyl)oxy-2-phenylethyl]propan-2-amine
CID 62108282
2-(2-fluorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine
CID 62107035
2-(3-bromophenyl)-2-(2-methylcyclohexyl)oxyethanamine
CID 55018005
1-chloro-3-(1-cyclopentyloxy-2-iodoethyl)benzene
CID 114772471
2-cyclobutyloxy-2-(3-fluorophenyl)-N-methylethanamine
CID 62383123
N-[2-(3-chlorophenyl)-2-(oxolan-3-yloxy)ethyl]propan-2-amine
CID 63556687
2-(3,4-dimethylcyclohexyl)oxy-N-methyl-2-(3-methylphenyl)ethanamine
CID 64745158
(3-chlorophenyl)-(2-methylcyclopentyl)methanamine
CID 107187965
(1S)-1-(3-chlorophenyl)-N-(cyclopentylmethyl)ethanamine
CID 81366631
1-(3-chlorophenyl)-1-cycloheptyl-N-methylmethanamine
CID 65400043

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine?
The IUPAC name of 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine (CID 55036427) is 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine.
What is the SMILES notation for 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine?
The canonical SMILES for 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine is CNCC(OC1CCCCC1C)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine?
The InChIKey is KTUOVMJRVCDUAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClNO/c1-12-6-3-4-9-15(12)19-16(11-18-2)13-7-5-8-14(17)10-13/h5,7-8,10,12,15-16,18H,3-4,6,9,11H2,1-2H3.
What are the key properties of 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine?
2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine has a molecular weight of 281.83 g/mol, XLogP of 4.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-methyl-2-(2-methylcyclohexyl)oxyethanamine is sourced from PubChem (CID 55036427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).