2-(2,5-dimethylphenoxy)cyclohexan-1-amine

C14H21NO — CID 43184593

IUPAC2-(2,5-dimethylphenoxy)cyclohexan-1-amine
SMILESCc1ccc(C)c(OC2CCCCC2N)c1
InChIInChI=1S/C14H21NO/c1-10-7-8-11(2)14(9-10)16-13-6-4-3-5-12(13)15/h7-9,12-13H,3-6,15H2,1-2H3
InChIKeyOJDMSMGFZPMTCW-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.95
Rot. Bonds2

About 2-(2,5-dimethylphenoxy)cyclohexan-1-amine

2-(2,5-dimethylphenoxy)cyclohexan-1-amine (PubChem CID 43184593) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-(2,5-dimethylphenoxy)cyclohexan-1-amine.

Molecular Properties

Compound Name2-(2,5-dimethylphenoxy)cyclohexan-1-amine
PubChem CID43184593
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-(2,5-dimethylphenoxy)cyclohexan-1-amine
SMILESCc1ccc(C)c(OC2CCCCC2N)c1
InChIInChI=1S/C14H21NO/c1-10-7-8-11(2)14(9-10)16-13-6-4-3-5-12(13)15/h7-9,12-13H,3-6,15H2,1-2H3
InChIKeyOJDMSMGFZPMTCW-UHFFFAOYSA-N
XLogP2.95
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(1R,2R)-2-(2,5-dimethylphenoxy)cyclohexan-1-ol
CID 102732512
trans-(1R,2R)-2-(2,5-dimethylphenoxy)cyclopentan-1-ol
CID 102735392
5-(2,5-dimethylphenoxy)-2,2-dimethylcyclopentan-1-ol
CID 79857169
2-(2,5-dimethylphenoxy)oxane
CID 15305690
2-(2,5-dimethylphenyl)cyclopentan-1-amine
CID 62605663
6-(2,5-dimethylphenoxy)-N-ethyl-2,2-dimethylcyclohexan-1-amine
CID 79836744
(1S)-1-[2-(2-ethylcyclohexyl)oxy-4-methylphenyl]ethanamine
CID 78953333
2-[2-[(1S)-1-aminoethyl]-5-methylphenoxy]cyclohexan-1-ol
CID 78947415
5-(2,5-dimethylphenoxy)-N,2,2-trimethylcyclopentan-1-amine
CID 79860197
2-(2,4-difluorophenoxy)cyclooctan-1-amine
CID 45253704
2-[2-(trifluoromethyl)phenoxy]cyclohexan-1-amine
CID 45283482
6-(2,5-dimethylphenoxy)-2,2-dimethyl-N-propylcyclohexan-1-amine
CID 79836581

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethylphenoxy)cyclohexan-1-amine?
The IUPAC name of 2-(2,5-dimethylphenoxy)cyclohexan-1-amine (CID 43184593) is 2-(2,5-dimethylphenoxy)cyclohexan-1-amine.
What is the SMILES notation for 2-(2,5-dimethylphenoxy)cyclohexan-1-amine?
The canonical SMILES for 2-(2,5-dimethylphenoxy)cyclohexan-1-amine is Cc1ccc(C)c(OC2CCCCC2N)c1.
What is the InChIKey of 2-(2,5-dimethylphenoxy)cyclohexan-1-amine?
The InChIKey is OJDMSMGFZPMTCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-10-7-8-11(2)14(9-10)16-13-6-4-3-5-12(13)15/h7-9,12-13H,3-6,15H2,1-2H3.
What are the key properties of 2-(2,5-dimethylphenoxy)cyclohexan-1-amine?
2-(2,5-dimethylphenoxy)cyclohexan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethylphenoxy)cyclohexan-1-amine is sourced from PubChem (CID 43184593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).