N-[2-(methoxymethyl)phenyl]cyclooctanamine

C16H25NO — CID 43677867

IUPACN-[2-(methoxymethyl)phenyl]cyclooctanamine
SMILESCOCc1ccccc1NC1CCCCCCC1
InChIInChI=1S/C16H25NO/c1-18-13-14-9-7-8-12-16(14)17-15-10-5-3-2-4-6-11-15/h7-9,12,15,17H,2-6,10-11,13H2,1H3
InChIKeyKKVPWFNVCJKXNC-UHFFFAOYSA-N
MW247.38 g/mol
LogP4.36
Rot. Bonds4

About N-[2-(methoxymethyl)phenyl]cyclooctanamine

N-[2-(methoxymethyl)phenyl]cyclooctanamine (PubChem CID 43677867) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is N-[2-(methoxymethyl)phenyl]cyclooctanamine.

Molecular Properties

Compound NameN-[2-(methoxymethyl)phenyl]cyclooctanamine
PubChem CID43677867
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC NameN-[2-(methoxymethyl)phenyl]cyclooctanamine
SMILESCOCc1ccccc1NC1CCCCCCC1
InChIInChI=1S/C16H25NO/c1-18-13-14-9-7-8-12-16(14)17-15-10-5-3-2-4-6-11-15/h7-9,12,15,17H,2-6,10-11,13H2,1H3
InChIKeyKKVPWFNVCJKXNC-UHFFFAOYSA-N
XLogP4.36
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(methoxymethyl)phenyl]-4,4-dimethylcycloheptan-1-amine
CID 65084084
N-[2-(ethoxymethyl)phenyl]cycloheptanamine
CID 43750302
4-tert-butyl-N-[2-(methoxymethyl)phenyl]cycloheptan-1-amine
CID 65089478
2-(methoxymethyl)-N-(4-propan-2-ylcyclohexyl)aniline
CID 62701624
N-[2-(methoxymethyl)phenyl]-4-propylcycloheptan-1-amine
CID 65086704
trans-(1R,2R)-2-[2-(methoxymethyl)anilino]cyclohexan-1-ol
CID 94220692
N-[2-(methoxymethyl)phenyl]-1-propan-2-ylpiperidin-4-amine
CID 43677869
N-cyclobutyl-2-(2-methoxyethyl)aniline
CID 102848928
N-cyclohexyl-2-(diethylaminomethyl)aniline
CID 43729330
N-(2,2-dimethylcyclohexyl)-2-(methoxymethyl)aniline
CID 79828961
N-(2-ethylcyclopentyl)-2-(methoxymethyl)aniline
CID 113483352
N-[[2-(cycloheptylamino)phenyl]methyl]-N-methylacetamide
CID 43692065

Frequently Asked Questions

What is the IUPAC name of N-[2-(methoxymethyl)phenyl]cyclooctanamine?
The IUPAC name of N-[2-(methoxymethyl)phenyl]cyclooctanamine (CID 43677867) is N-[2-(methoxymethyl)phenyl]cyclooctanamine.
What is the SMILES notation for N-[2-(methoxymethyl)phenyl]cyclooctanamine?
The canonical SMILES for N-[2-(methoxymethyl)phenyl]cyclooctanamine is COCc1ccccc1NC1CCCCCCC1.
What is the InChIKey of N-[2-(methoxymethyl)phenyl]cyclooctanamine?
The InChIKey is KKVPWFNVCJKXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO/c1-18-13-14-9-7-8-12-16(14)17-15-10-5-3-2-4-6-11-15/h7-9,12,15,17H,2-6,10-11,13H2,1H3.
What are the key properties of N-[2-(methoxymethyl)phenyl]cyclooctanamine?
N-[2-(methoxymethyl)phenyl]cyclooctanamine has a molecular weight of 247.38 g/mol, XLogP of 4.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methoxymethyl)phenyl]cyclooctanamine is sourced from PubChem (CID 43677867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).