N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine

C16H19NO2 — CID 43632427

IUPACN-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine
SMILESCOc1ccccc1C1CC(NCc2ccco2)C1
InChIInChI=1S/C16H19NO2/c1-18-16-7-3-2-6-15(16)12-9-13(10-12)17-11-14-5-4-8-19-14/h2-8,12-13,17H,9-11H2,1H3
InChIKeyFHHSQPZFYDJEST-UHFFFAOYSA-N
MW257.33 g/mol
LogP3.32
Rot. Bonds5

About N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine

N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine (PubChem CID 43632427) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine
PubChem CID43632427
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine
SMILESCOc1ccccc1C1CC(NCc2ccco2)C1
InChIInChI=1S/C16H19NO2/c1-18-16-7-3-2-6-15(16)12-9-13(10-12)17-11-14-5-4-8-19-14/h2-8,12-13,17H,9-11H2,1H3
InChIKeyFHHSQPZFYDJEST-UHFFFAOYSA-N
XLogP3.32
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-3-(2-methoxyphenyl)cyclobutan-1-amine
CID 43632771
2-[[[3-(2-methoxyphenyl)cyclobutyl]amino]methyl]phenol
CID 115619481
N-[(4-fluorophenyl)methyl]-3-(2-methoxyphenyl)cyclobutan-1-amine
CID 43633599
N-(2-methoxyethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine
CID 43632651
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3-(2-methoxyphenyl)cyclobutan-1-amine
CID 78953381
3-(2-methoxyphenyl)-N-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclobutan-1-amine
CID 61042870
3-(2-methoxyphenyl)-N-[(1-methylpyrrolidin-3-yl)methyl]cyclobutan-1-amine
CID 60856262
N'-ethyl-N-[3-(2-methoxyphenyl)cyclobutyl]-N'-methylethane-1,2-diamine
CID 62635026
2-[[3-(2-methoxyphenyl)cyclobutyl]amino]-N,N-dimethylacetamide
CID 43635304
4-[[3-(2-methoxyphenyl)cyclobutyl]amino]butanoic acid
CID 60782936
3-(2-methoxyphenyl)-N-(5,5,5-trifluoropentyl)cyclobutan-1-amine
CID 115516703
N-[(1-ethylpyrrolidin-3-yl)methyl]-3-(2-methoxyphenyl)cyclobutan-1-amine
CID 60856193

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine?
The IUPAC name of N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine (CID 43632427) is N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine.
What is the SMILES notation for N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine?
The canonical SMILES for N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine is COc1ccccc1C1CC(NCc2ccco2)C1.
What is the InChIKey of N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine?
The InChIKey is FHHSQPZFYDJEST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-18-16-7-3-2-6-15(16)12-9-13(10-12)17-11-14-5-4-8-19-14/h2-8,12-13,17H,9-11H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine?
N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine has a molecular weight of 257.33 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-3-(2-methoxyphenyl)cyclobutan-1-amine is sourced from PubChem (CID 43632427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).