2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine

C18H29NO — CID 65424370

IUPAC2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine
SMILESCOc1ccccc1CC(N)C1CCC(C(C)C)CC1
InChIInChI=1S/C18H29NO/c1-13(2)14-8-10-15(11-9-14)17(19)12-16-6-4-5-7-18(16)20-3/h4-7,13-15,17H,8-12,19H2,1-3H3
InChIKeyQFDCIWLYDAWQSW-UHFFFAOYSA-N
MW275.44 g/mol
LogP4.03
Rot. Bonds5

About 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine

2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine (PubChem CID 65424370) has the molecular formula C18H29NO and a molecular weight of 275.44 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine
PubChem CID65424370
Molecular FormulaC18H29NO
Molecular Weight275.44 g/mol
Exact Mass275.22
IUPAC Name2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine
SMILESCOc1ccccc1CC(N)C1CCC(C(C)C)CC1
InChIInChI=1S/C18H29NO/c1-13(2)14-8-10-15(11-9-14)17(19)12-16-6-4-5-7-18(16)20-3/h4-7,13-15,17H,8-12,19H2,1-3H3
InChIKeyQFDCIWLYDAWQSW-UHFFFAOYSA-N
XLogP4.03
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.44
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-bromo-2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 65423793
[3-cyclopropyl-1-(2-methoxyphenyl)butan-2-yl]hydrazine
CID 105289407
1-(2-methoxyphenyl)propan-2-amine;hydrochloride
CID 3029810
1-cyclopropyl-3-(2-methoxyphenyl)propane-1,2-diol
CID 103456984
(2-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methanamine
CID 65423601
1-[1-[1-(2-methoxyphenyl)propan-2-yl]pyrrolidin-3-yl]ethanamine
CID 103975668
2-(2-amino-2-cyclopropylethyl)phenol
CID 83827756
2-(5-fluoro-2-methylphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 105374002
1-(2-chloro-2-cyclopentylethyl)-2-methoxybenzene
CID 63017211
2-(1-benzothiophen-3-yl)-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 65424756
1-(1,4-dithian-2-yl)-2-(2-methoxyphenyl)ethanamine
CID 79971404
3-(2-methoxyphenyl)-2-methylpropan-1-amine
CID 22024848

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine?
The IUPAC name of 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine (CID 65424370) is 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine.
What is the SMILES notation for 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine?
The canonical SMILES for 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine is COc1ccccc1CC(N)C1CCC(C(C)C)CC1.
What is the InChIKey of 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine?
The InChIKey is QFDCIWLYDAWQSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO/c1-13(2)14-8-10-15(11-9-14)17(19)12-16-6-4-5-7-18(16)20-3/h4-7,13-15,17H,8-12,19H2,1-3H3.
What are the key properties of 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine?
2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine has a molecular weight of 275.44 g/mol, XLogP of 4.03, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1-(4-propan-2-ylcyclohexyl)ethanamine is sourced from PubChem (CID 65424370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).