4-[(2-methylphenyl)methoxy]cyclohexan-1-amine

C14H21NO — CID 62807392

IUPAC4-[(2-methylphenyl)methoxy]cyclohexan-1-amine
SMILESCc1ccccc1COC1CCC(N)CC1
InChIInChI=1S/C14H21NO/c1-11-4-2-3-5-12(11)10-16-14-8-6-13(15)7-9-14/h2-5,13-14H,6-10,15H2,1H3
InChIKeyKNWDKQXINBFUNO-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.78
Rot. Bonds3

About 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine

4-[(2-methylphenyl)methoxy]cyclohexan-1-amine (PubChem CID 62807392) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[(2-methylphenyl)methoxy]cyclohexan-1-amine
PubChem CID62807392
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-[(2-methylphenyl)methoxy]cyclohexan-1-amine
SMILESCc1ccccc1COC1CCC(N)CC1
InChIInChI=1S/C14H21NO/c1-11-4-2-3-5-12(11)10-16-14-8-6-13(15)7-9-14/h2-5,13-14H,6-10,15H2,1H3
InChIKeyKNWDKQXINBFUNO-UHFFFAOYSA-N
XLogP2.78
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine?
The IUPAC name of 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine (CID 62807392) is 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine.
What is the SMILES notation for 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine?
The canonical SMILES for 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine is Cc1ccccc1COC1CCC(N)CC1.
What is the InChIKey of 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine?
The InChIKey is KNWDKQXINBFUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11-4-2-3-5-12(11)10-16-14-8-6-13(15)7-9-14/h2-5,13-14H,6-10,15H2,1H3.
What are the key properties of 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine?
4-[(2-methylphenyl)methoxy]cyclohexan-1-amine has a molecular weight of 219.33 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methylphenyl)methoxy]cyclohexan-1-amine is sourced from PubChem (CID 62807392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).