[4-(cycloheptyloxymethyl)phenyl]methanamine

C15H23NO — CID 61069356

IUPAC[4-(cycloheptyloxymethyl)phenyl]methanamine
SMILESNCc1ccc(COC2CCCCCC2)cc1
InChIInChI=1S/C15H23NO/c16-11-13-7-9-14(10-8-13)12-17-15-5-3-1-2-4-6-15/h7-10,15H,1-6,11-12,16H2
InChIKeyRUUBTUGMXCPFKM-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.38
Rot. Bonds4

About [4-(cycloheptyloxymethyl)phenyl]methanamine

[4-(cycloheptyloxymethyl)phenyl]methanamine (PubChem CID 61069356) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is [4-(cycloheptyloxymethyl)phenyl]methanamine.

Molecular Properties

Compound Name[4-(cycloheptyloxymethyl)phenyl]methanamine
PubChem CID61069356
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name[4-(cycloheptyloxymethyl)phenyl]methanamine
SMILESNCc1ccc(COC2CCCCCC2)cc1
InChIInChI=1S/C15H23NO/c16-11-13-7-9-14(10-8-13)12-17-15-5-3-1-2-4-6-15/h7-10,15H,1-6,11-12,16H2
InChIKeyRUUBTUGMXCPFKM-UHFFFAOYSA-N
XLogP3.38
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(cyclohexyloxymethyl)benzenethiol
CID 91656879
4-(aminomethyl)-N-[4-(cyclopentyloxymethyl)phenyl]benzamide
CID 119330109
[4-[(4-methyliodanuidylcyclohexyl)oxymethyl]phenyl]methanamine
CID 169243484
4-(cycloheptyloxymethyl)benzenecarbothioamide
CID 61071587
[4-(2-cyclohexyloxyethoxy)phenyl]methanamine
CID 43253949
[4-(2-cycloheptyloxyethoxy)phenyl]methanamine
CID 61069915
[4-(cycloheptyloxymethyl)phenyl]-trimethylsilane
CID 103438663
azane;cyclopentyloxymethylbenzene
CID 69411306
[5-(cyclohexyloxymethyl)-2-methoxyphenyl]methanamine
CID 65338634
[5-(cyclopentyloxymethyl)-2-fluorophenyl]methanamine
CID 107878875
1-(cyclobutyloxymethyl)-4-iodobenzene
CID 65490740
[4-[4-(cyclopentyloxymethyl)phenyl]phenyl]methanol
CID 126675322

Frequently Asked Questions

What is the IUPAC name of [4-(cycloheptyloxymethyl)phenyl]methanamine?
The IUPAC name of [4-(cycloheptyloxymethyl)phenyl]methanamine (CID 61069356) is [4-(cycloheptyloxymethyl)phenyl]methanamine.
What is the SMILES notation for [4-(cycloheptyloxymethyl)phenyl]methanamine?
The canonical SMILES for [4-(cycloheptyloxymethyl)phenyl]methanamine is NCc1ccc(COC2CCCCCC2)cc1.
What is the InChIKey of [4-(cycloheptyloxymethyl)phenyl]methanamine?
The InChIKey is RUUBTUGMXCPFKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c16-11-13-7-9-14(10-8-13)12-17-15-5-3-1-2-4-6-15/h7-10,15H,1-6,11-12,16H2.
What are the key properties of [4-(cycloheptyloxymethyl)phenyl]methanamine?
[4-(cycloheptyloxymethyl)phenyl]methanamine has a molecular weight of 233.35 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cycloheptyloxymethyl)phenyl]methanamine is sourced from PubChem (CID 61069356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).