N-(4-methoxyphenyl)cyclooctanamine

C15H23NO — CID 29275692

IUPACN-(4-methoxyphenyl)cyclooctanamine
SMILESCOc1ccc(NC2CCCCCCC2)cc1
InChIInChI=1S/C15H23NO/c1-17-15-11-9-14(10-12-15)16-13-7-5-3-2-4-6-8-13/h9-13,16H,2-8H2,1H3
InChIKeyLUJFUSWGOIJLCY-UHFFFAOYSA-N
MW233.35 g/mol
LogP4.22
Rot. Bonds3

About N-(4-methoxyphenyl)cyclooctanamine

N-(4-methoxyphenyl)cyclooctanamine (PubChem CID 29275692) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is N-(4-methoxyphenyl)cyclooctanamine.

Molecular Properties

Compound NameN-(4-methoxyphenyl)cyclooctanamine
PubChem CID29275692
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC NameN-(4-methoxyphenyl)cyclooctanamine
SMILESCOc1ccc(NC2CCCCCCC2)cc1
InChIInChI=1S/C15H23NO/c1-17-15-11-9-14(10-12-15)16-13-7-5-3-2-4-6-8-13/h9-13,16H,2-8H2,1H3
InChIKeyLUJFUSWGOIJLCY-UHFFFAOYSA-N
XLogP4.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

N-[4-(cycloheptylamino)phenyl]-4-methoxybenzamide
CID 112984992
N-[4-(cycloheptylamino)phenyl]-2-(4-methoxyphenyl)acetamide
CID 112985000
N-(4-methoxyphenyl)spiro[4.5]decan-8-amine
CID 114817121
(3S)-N-(4-methoxyphenyl)thian-3-amine
CID 94885728
trans-(1R,2R)-2-(4-methoxyanilino)cyclooctan-1-ol
CID 15891180
N-[4-(cyclopropylamino)phenyl]-4-methoxybenzenesulfonamide
CID 112980023
1-iodo-N-(4-methoxyphenyl)piperidin-3-amine
CID 166817113
methyl 2-[4-(cyclooctylamino)phenoxy]acetate
CID 43676794
N-[4-(cycloheptylamino)phenyl]-3,5-dimethoxybenzamide
CID 112984993
4-N-cycloheptyl-2-N-(4-methoxyphenyl)pyrimidine-2,4-diamine
CID 112899904
4-N-cycloheptyl-6-N-(4-methoxyphenyl)pyrimidine-4,5,6-triamine
CID 19149168
methyl 4-(4-methoxyanilino)cyclohexane-1-carboxylate
CID 13394768

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)cyclooctanamine?
The IUPAC name of N-(4-methoxyphenyl)cyclooctanamine (CID 29275692) is N-(4-methoxyphenyl)cyclooctanamine.
What is the SMILES notation for N-(4-methoxyphenyl)cyclooctanamine?
The canonical SMILES for N-(4-methoxyphenyl)cyclooctanamine is COc1ccc(NC2CCCCCCC2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)cyclooctanamine?
The InChIKey is LUJFUSWGOIJLCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-17-15-11-9-14(10-12-15)16-13-7-5-3-2-4-6-8-13/h9-13,16H,2-8H2,1H3.
What are the key properties of N-(4-methoxyphenyl)cyclooctanamine?
N-(4-methoxyphenyl)cyclooctanamine has a molecular weight of 233.35 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)cyclooctanamine is sourced from PubChem (CID 29275692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).