[5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine

C17H21NO — CID 11514389

IUPAC[5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine
SMILESNCC1CCC(CCc2cccc3ccccc23)O1
InChIInChI=1S/C17H21NO/c18-12-16-11-10-15(19-16)9-8-14-6-3-5-13-4-1-2-7-17(13)14/h1-7,15-16H,8-12,18H2
InChIKeyQLXIMJBRAWACSR-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.28
Rot. Bonds4

About [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine

[5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine (PubChem CID 11514389) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine.

Molecular Properties

Compound Name[5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine
PubChem CID11514389
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name[5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine
SMILESNCC1CCC(CCc2cccc3ccccc23)O1
InChIInChI=1S/C17H21NO/c18-12-16-11-10-15(19-16)9-8-14-6-3-5-13-4-1-2-7-17(13)14/h1-7,15-16H,8-12,18H2
InChIKeyQLXIMJBRAWACSR-UHFFFAOYSA-N
XLogP3.28
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Aminomethyl)-5-phenethyltetrahydrofuran
CID 11506691
2-(Aminomethyl)-5-(1''-naphthyl)tetrahydrofuran
CID 11572135
2-(Aminomethyl)-5-(2''-naphthyl)tetrahydrofuran
CID 11637187
N-(naphthalen-1-ylmethyl)-1-[(2R)-oxolan-2-yl]methanamine
CID 964929
(Naphthylmethyl)(oxolan-2-ylmethyl)amine
CID 3156809
Trimethyl-[2-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propoxy]ethyl]azanium
CID 18541
N',N'-diethyl-N-[2-(naphthalen-1-ylmethyl)-3-(oxolan-2-yl)propyl]ethane-1,2-diamine
CID 25344
(4-Fluoronaphthalen-1-yl)-(oxolan-2-yl)methanamine
CID 64137884
(4-Fluoronaphthalen-1-yl)-(oxan-2-yl)methanamine
CID 64139728
1-(4-Fluoronaphthalen-1-yl)-2-(oxolan-2-yl)ethanamine
CID 65156003
(4-Fluoronaphthalen-1-yl)-(2,4,5-trimethyloxolan-3-yl)methanamine
CID 65156051
1-(4-Fluoronaphthalen-1-yl)-3-(oxolan-2-yl)propan-1-amine
CID 65156052

Frequently Asked Questions

What is the IUPAC name of [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine?
The IUPAC name of [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine (CID 11514389) is [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine.
What is the SMILES notation for [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine?
The canonical SMILES for [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine is NCC1CCC(CCc2cccc3ccccc23)O1.
What is the InChIKey of [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine?
The InChIKey is QLXIMJBRAWACSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c18-12-16-11-10-15(19-16)9-8-14-6-3-5-13-4-1-2-7-17(13)14/h1-7,15-16H,8-12,18H2.
What are the key properties of [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine?
[5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine has a molecular weight of 255.36 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-naphthalen-1-ylethyl)oxolan-2-yl]methanamine is sourced from PubChem (CID 11514389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).