2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine

C18H24N2O — CID 103532164

IUPAC2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
SMILESCNC(CN1CCC(OC)C1)c1ccc2ccccc2c1
InChIInChI=1S/C18H24N2O/c1-19-18(13-20-10-9-17(12-20)21-2)16-8-7-14-5-3-4-6-15(14)11-16/h3-8,11,17-19H,9-10,12-13H2,1-2H3
InChIKeyJCAOUHPTAYEJLU-UHFFFAOYSA-N
MW284.40 g/mol
LogP2.82
Rot. Bonds5

About 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine

2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine (PubChem CID 103532164) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine.

Molecular Properties

Compound Name2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
PubChem CID103532164
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
SMILESCNC(CN1CCC(OC)C1)c1ccc2ccccc2c1
InChIInChI=1S/C18H24N2O/c1-19-18(13-20-10-9-17(12-20)21-2)16-8-7-14-5-3-4-6-15(14)11-16/h3-8,11,17-19H,9-10,12-13H2,1-2H3
InChIKeyJCAOUHPTAYEJLU-UHFFFAOYSA-N
XLogP2.82
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxypyrrolidin-1-yl)-1-naphthalen-2-ylethanamine
CID 103532357
2-[(3S)-3-methoxypyrrolidin-1-yl]-N-methyl-1-phenylethanamine
CID 135374431
2-(3-methoxypiperidin-1-yl)-N-methyl-1-phenylethanamine
CID 102965612
1-(2-ethoxyphenyl)-2-(3-methoxypyrrolidin-1-yl)-N-methylethanamine
CID 103532336
2-(3-methylpyrrolidin-1-yl)-1-naphthalen-2-ylethanamine
CID 61224802
1-(2-fluorophenyl)-3-(3-methoxypyrrolidin-1-yl)-N-methylpropan-1-amine
CID 103538884
1-(3-methoxyphenyl)-2-(3-methoxypyrrolidin-1-yl)ethanol
CID 103536862
N-ethyl-1-(3-methoxyphenyl)-2-(3-methoxypiperidin-1-yl)ethanamine
CID 102965538
2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
CID 63219539
1-(3-bromophenyl)-3-(4-methoxypiperidin-1-yl)-N-methylpropan-1-amine
CID 62618049
(1S)-2-[(3S)-3-[tert-butyl(dimethyl)silyl]oxypyrrolidin-1-yl]-N-methyl-1-(3-phenylmethoxyphenyl)ethanamine
CID 54559728
(3S)-1-[(2S)-2-(methylamino)-2-phenylethyl]pyrrolidin-3-ol;dihydrochloride
CID 23594216

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The IUPAC name of 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine (CID 103532164) is 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine.
What is the SMILES notation for 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The canonical SMILES for 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine is CNC(CN1CCC(OC)C1)c1ccc2ccccc2c1.
What is the InChIKey of 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The InChIKey is JCAOUHPTAYEJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c1-19-18(13-20-10-9-17(12-20)21-2)16-8-7-14-5-3-4-6-15(14)11-16/h3-8,11,17-19H,9-10,12-13H2,1-2H3.
What are the key properties of 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine has a molecular weight of 284.40 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine is sourced from PubChem (CID 103532164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).