N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine

C19H29NO — CID 43633186

IUPACN-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine
SMILESCOc1ccc(C2CC(NC3CCCCCCC3)C2)cc1
InChIInChI=1S/C19H29NO/c1-21-19-11-9-15(10-12-19)16-13-18(14-16)20-17-7-5-3-2-4-6-8-17/h9-12,16-18,20H,2-8,13-14H2,1H3
InChIKeyUMWNTDJSSRNMLR-UHFFFAOYSA-N
MW287.45 g/mol
LogP4.64
Rot. Bonds4

About N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine

N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine (PubChem CID 43633186) has the molecular formula C19H29NO and a molecular weight of 287.45 g/mol. Its IUPAC name is N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine.

Molecular Properties

Compound NameN-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine
PubChem CID43633186
Molecular FormulaC19H29NO
Molecular Weight287.45 g/mol
Exact Mass287.22
IUPAC NameN-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine
SMILESCOc1ccc(C2CC(NC3CCCCCCC3)C2)cc1
InChIInChI=1S/C19H29NO/c1-21-19-11-9-15(10-12-19)16-13-18(14-16)20-17-7-5-3-2-4-6-8-17/h9-12,16-18,20H,2-8,13-14H2,1H3
InChIKeyUMWNTDJSSRNMLR-UHFFFAOYSA-N
XLogP4.64
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-cyclopentylethyl]-3-(4-methoxyphenyl)cyclobutan-1-amine
CID 81395845
N-[3-(4-methoxyphenyl)cyclobutyl]-1,1-dioxothiolan-3-amine
CID 43632787
N-[3-(4-methoxyphenyl)cyclobutyl]piperidin-1-amine
CID 83007160
N-(2-cyclopentylethyl)-3-(4-methoxyphenyl)cyclobutan-1-amine
CID 60920137
2-[[3-(4-methoxyphenyl)cyclobutyl]amino]cyclopentane-1-carbonitrile
CID 62962017
3-[[3-(4-methoxyphenyl)cyclobutyl]amino]piperidin-2-one
CID 62092299
N-(2-ethylcyclopropyl)-3-(4-methoxyphenyl)cyclobutan-1-amine
CID 114107711
bromomethane;1-cyclopentyl-4-methoxybenzene
CID 160663013
1-cyclohexyl-4-(4-methoxyphenyl)benzene;ethene
CID 144983864
N-(4-methoxyphenyl)cyclooctanamine
CID 29275692
N-[(4-methoxyphenyl)methyl]cycloheptanamine
CID 784052
3-(cyclododecylamino)-5-phenylcyclohexan-1-ol
CID 155454677

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine?
The IUPAC name of N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine (CID 43633186) is N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine.
What is the SMILES notation for N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine?
The canonical SMILES for N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine is COc1ccc(C2CC(NC3CCCCCCC3)C2)cc1.
What is the InChIKey of N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine?
The InChIKey is UMWNTDJSSRNMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO/c1-21-19-11-9-15(10-12-19)16-13-18(14-16)20-17-7-5-3-2-4-6-8-17/h9-12,16-18,20H,2-8,13-14H2,1H3.
What are the key properties of N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine?
N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine has a molecular weight of 287.45 g/mol, XLogP of 4.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-methoxyphenyl)cyclobutyl]cyclooctanamine is sourced from PubChem (CID 43633186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).