4-[(3-methylphenyl)methoxy]cyclohexan-1-amine

C14H21NO — CID 62807401

IUPAC4-[(3-methylphenyl)methoxy]cyclohexan-1-amine
SMILESCc1cccc(COC2CCC(N)CC2)c1
InChIInChI=1S/C14H21NO/c1-11-3-2-4-12(9-11)10-16-14-7-5-13(15)6-8-14/h2-4,9,13-14H,5-8,10,15H2,1H3
InChIKeyCSFKAOQWSRNQJM-UHFFFAOYSA-N
MW219.33 g/mol
LogP2.78
Rot. Bonds3

About 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine

4-[(3-methylphenyl)methoxy]cyclohexan-1-amine (PubChem CID 62807401) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine.

Molecular Properties

Compound Name4-[(3-methylphenyl)methoxy]cyclohexan-1-amine
PubChem CID62807401
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name4-[(3-methylphenyl)methoxy]cyclohexan-1-amine
SMILESCc1cccc(COC2CCC(N)CC2)c1
InChIInChI=1S/C14H21NO/c1-11-3-2-4-12(9-11)10-16-14-7-5-13(15)6-8-14/h2-4,9,13-14H,5-8,10,15H2,1H3
InChIKeyCSFKAOQWSRNQJM-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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Related Compounds

4-[(3-methylphenyl)methoxy]piperidine;hydrochloride
CID 45075442
3-[(4-aminocyclohexyl)oxymethyl]benzamide
CID 62807395
N-[4-[(3-methylphenyl)methoxy]cyclohexylidene]hydroxylamine
CID 113414232
(3R)-3-[(3-methylphenyl)methoxy]pyrrolidine
CID 26191874
cis-(1R,3S)-3-[(3-methylphenyl)methoxy]cyclohexan-1-ol
CID 141095179
4-[(2-methylphenyl)methoxy]cyclohexan-1-amine
CID 62807392
3-phenylmethoxycyclopentan-1-amine
CID 79421215
1-methyl-3-[(3-methylphenyl)methoxymethyl]benzene
CID 15640186
1-[[3-[(3-methylphenyl)methoxy]phenyl]methyl]piperidin-4-amine
CID 39308220
N-(4-aminocyclohexyl)-2-(3-methylphenyl)acetamide
CID 62387693
N-(4-chlorophenyl)-2-[4-[(3-methylphenyl)methoxy]cyclohexyl]propanamide
CID 138553761
N-(1-methylcyclohexyl)-2-[4-[(3-methylphenyl)methoxy]cyclohexyl]propanamide
CID 138553616

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine?
The IUPAC name of 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine (CID 62807401) is 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine.
What is the SMILES notation for 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine?
The canonical SMILES for 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine is Cc1cccc(COC2CCC(N)CC2)c1.
What is the InChIKey of 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine?
The InChIKey is CSFKAOQWSRNQJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-11-3-2-4-12(9-11)10-16-14-7-5-13(15)6-8-14/h2-4,9,13-14H,5-8,10,15H2,1H3.
What are the key properties of 4-[(3-methylphenyl)methoxy]cyclohexan-1-amine?
4-[(3-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-[(3-methylphenyl)methoxy]cyclohexan-1-amine is sourced from PubChem (CID 62807401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).