N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine

C18H23NO — CID 103987345

IUPACN-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine
SMILESCCNC(CC1CCOC1)c1ccc2ccccc2c1
InChIInChI=1S/C18H23NO/c1-2-19-18(11-14-9-10-20-13-14)17-8-7-15-5-3-4-6-16(15)12-17/h3-8,12,14,18-19H,2,9-11,13H2,1H3
InChIKeyZHQHWCHMTPSNIA-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.92
Rot. Bonds5

About N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine

N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine (PubChem CID 103987345) has the molecular formula C18H23NO and a molecular weight of 269.39 g/mol. Its IUPAC name is N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine
PubChem CID103987345
Molecular FormulaC18H23NO
Molecular Weight269.39 g/mol
Exact Mass269.18
IUPAC NameN-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine
SMILESCCNC(CC1CCOC1)c1ccc2ccccc2c1
InChIInChI=1S/C18H23NO/c1-2-19-18(11-14-9-10-20-13-14)17-8-7-15-5-3-4-6-16(15)12-17/h3-8,12,14,18-19H,2,9-11,13H2,1H3
InChIKeyZHQHWCHMTPSNIA-UHFFFAOYSA-N
XLogP3.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-N-ethyl-2-(oxolan-3-yl)ethanamine
CID 103987271
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-ethyl-2-(oxolan-3-yl)ethanamine
CID 103987161
1-naphthalen-2-yl-2-(oxolan-3-yl)ethanol
CID 113362057
N-ethyl-2-(oxolan-3-yl)-1-pyridin-3-ylethanamine
CID 103987178
N-ethyl-2-(oxolan-3-yl)-1-(4-propoxyphenyl)ethanamine
CID 103987406
N-ethyl-1-(7-fluoro-1-benzofuran-2-yl)-2-(oxolan-3-yl)ethanamine
CID 114730776
N-[2-(oxolan-3-yl)-1-(4-propan-2-ylphenyl)ethyl]propan-1-amine
CID 103987493
1-(3-ethoxyphenyl)-N-methyl-2-(oxolan-3-yl)ethanamine
CID 113362131
N-[2-(oxolan-3-yl)-1-(3-propylphenyl)ethyl]propan-1-amine
CID 116545062
N-methyl-1-naphthalen-2-yl-2-(oxolan-2-yl)ethanamine
CID 55104166
2-(2-cyclopropylethoxy)-N-ethyl-1-naphthalen-2-ylethanamine
CID 106200656
N-ethyl-1-naphthalen-2-ylbutan-1-amine
CID 62716918

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine?
The IUPAC name of N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine (CID 103987345) is N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine.
What is the SMILES notation for N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine?
The canonical SMILES for N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine is CCNC(CC1CCOC1)c1ccc2ccccc2c1.
What is the InChIKey of N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine?
The InChIKey is ZHQHWCHMTPSNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO/c1-2-19-18(11-14-9-10-20-13-14)17-8-7-15-5-3-4-6-16(15)12-17/h3-8,12,14,18-19H,2,9-11,13H2,1H3.
What are the key properties of N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine?
N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine has a molecular weight of 269.39 g/mol, XLogP of 3.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-naphthalen-2-yl-2-(oxolan-3-yl)ethanamine is sourced from PubChem (CID 103987345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).