[3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine

C16H15NO2 — CID 62458706

IUPAC[3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine
SMILESNCc1occc1COc1cccc2ccccc12
InChIInChI=1S/C16H15NO2/c17-10-16-13(8-9-18-16)11-19-15-7-3-5-12-4-1-2-6-14(12)15/h1-9H,10-11,17H2
InChIKeyVHBDFUDJUJEPCS-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.47
Rot. Bonds4

About [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine

[3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine (PubChem CID 62458706) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine.

Molecular Properties

Compound Name[3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine
PubChem CID62458706
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name[3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine
SMILESNCc1occc1COc1cccc2ccccc12
InChIInChI=1S/C16H15NO2/c17-10-16-13(8-9-18-16)11-19-15-7-3-5-12-4-1-2-6-14(12)15/h1-9H,10-11,17H2
InChIKeyVHBDFUDJUJEPCS-UHFFFAOYSA-N
XLogP3.47
TPSA48.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[[2-(trifluoromethyl)phenoxy]methyl]furan-2-yl]methanamine
CID 55077539
[3-[(4-bromophenoxy)methyl]furan-2-yl]methanamine
CID 62454073
[3-[(2-ethoxyphenyl)methyl]furan-2-yl]methanamine
CID 121004432
[3-[(4-chloro-2,6-dimethylphenoxy)methyl]furan-2-yl]methanamine
CID 62450029
oxirane;1-prop-2-enoxynaphthalene
CID 174790954
2-(naphthalen-1-yloxymethyl)benzoic acid
CID 43473128
[1-methyl-2-(naphthalen-1-yloxymethyl)imidazol-4-yl]methanamine
CID 82304830
[4-[3-(naphthalen-1-yloxymethyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]methanamine
CID 167848574
[3-[(2-fluorophenoxy)methyl]-1-benzofuran-7-yl]methanamine
CID 117180945
N-[[2-(aminomethyl)furan-3-yl]methyl]-2-methoxy-N-methylaniline
CID 62428788
[3-[(4-butylphenoxy)methyl]furan-2-yl]methanamine
CID 115493291
2-(aminomethyl)-5-(2-naphthalen-1-yloxyethoxy)pyran-4-one
CID 93212181

Frequently Asked Questions

What is the IUPAC name of [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine?
The IUPAC name of [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine (CID 62458706) is [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine.
What is the SMILES notation for [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine?
The canonical SMILES for [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine is NCc1occc1COc1cccc2ccccc12.
What is the InChIKey of [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine?
The InChIKey is VHBDFUDJUJEPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c17-10-16-13(8-9-18-16)11-19-15-7-3-5-12-4-1-2-6-14(12)15/h1-9H,10-11,17H2.
What are the key properties of [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine?
[3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine has a molecular weight of 253.30 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(naphthalen-1-yloxymethyl)furan-2-yl]methanamine is sourced from PubChem (CID 62458706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).