[5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

C17H21NO2 — CID 107126586

IUPAC[5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESCOCc1ccc(C(N)C2CCc3ccccc3C2)o1
InChIInChI=1S/C17H21NO2/c1-19-11-15-8-9-16(20-15)17(18)14-7-6-12-4-2-3-5-13(12)10-14/h2-5,8-9,14,17H,6-7,10-11,18H2,1H3
InChIKeyBGVCTRPEWJLBQC-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.23
Rot. Bonds4

About [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

[5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (PubChem CID 107126586) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound Name[5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
PubChem CID107126586
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name[5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESCOCc1ccc(C(N)C2CCc3ccccc3C2)o1
InChIInChI=1S/C17H21NO2/c1-19-11-15-8-9-16(20-15)17(18)14-7-6-12-4-2-3-5-13(12)10-14/h2-5,8-9,14,17H,6-7,10-11,18H2,1H3
InChIKeyBGVCTRPEWJLBQC-UHFFFAOYSA-N
XLogP3.23
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methylfuran-2-yl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126532
[2-methoxy-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethyl]hydrazine
CID 105234697
1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethane-1,2-diamine
CID 91218484
2-cyclohexyl-1-[5-(methoxymethyl)furan-2-yl]ethanamine
CID 113461702
1,2,3,4-tetrahydronaphthalen-2-yl-(2,4,6-trimethylphenyl)methanamine
CID 107126496
2,3-dihydro-1H-inden-5-yl(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126500
(2-chloro-4-methoxyphenyl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107126524
(2-methylthiophen-3-yl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 102832882
(1-ethyl-4-methoxypyrazol-5-yl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 114655860
ethane;2-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 142915182
2-phenyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanamine
CID 65404384
4-methoxy-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)butan-1-amine
CID 114855994

Frequently Asked Questions

What is the IUPAC name of [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The IUPAC name of [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (CID 107126586) is [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.
What is the SMILES notation for [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The canonical SMILES for [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is COCc1ccc(C(N)C2CCc3ccccc3C2)o1.
What is the InChIKey of [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The InChIKey is BGVCTRPEWJLBQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-19-11-15-8-9-16(20-15)17(18)14-7-6-12-4-2-3-5-13(12)10-14/h2-5,8-9,14,17H,6-7,10-11,18H2,1H3.
What are the key properties of [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
[5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine has a molecular weight of 271.36 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(methoxymethyl)furan-2-yl]-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 107126586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).