2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine

C19H26N2 — CID 63219539

IUPAC2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
SMILESCNC(CN1CCCC1(C)C)c1ccc2ccccc2c1
InChIInChI=1S/C19H26N2/c1-19(2)11-6-12-21(19)14-18(20-3)17-10-9-15-7-4-5-8-16(15)13-17/h4-5,7-10,13,18,20H,6,11-12,14H2,1-3H3
InChIKeyDIBWXVTWXFSLNN-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.97
Rot. Bonds4

About 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine

2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine (PubChem CID 63219539) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine.

Molecular Properties

Compound Name2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
PubChem CID63219539
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
SMILESCNC(CN1CCCC1(C)C)c1ccc2ccccc2c1
InChIInChI=1S/C19H26N2/c1-19(2)11-6-12-21(19)14-18(20-3)17-10-9-15-7-4-5-8-16(15)13-17/h4-5,7-10,13,18,20H,6,11-12,14H2,1-3H3
InChIKeyDIBWXVTWXFSLNN-UHFFFAOYSA-N
XLogP3.97
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dimethylphenyl)-2-(2,2-dimethylpyrrolidin-1-yl)-N-methylethanamine
CID 63220037
2-(2,2-dimethylpyrrolidin-1-yl)-N-ethyl-1-(4-propan-2-ylphenyl)ethanamine
CID 63469155
N-methyl-1-(1-methylcyclohexyl)-1-naphthalen-2-ylmethanamine
CID 106830028
3-(2,2-dimethylpyrrolidin-1-yl)-1-(3-fluorophenyl)-N-methylpropan-1-amine
CID 55160971
2-(3-methoxypyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
CID 103532164
2-(cyclohexen-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
CID 116661619
2-(4,5-dimethylimidazol-1-yl)-N-methyl-1-naphthalen-2-ylethanamine
CID 62352149
N-methyl-1-naphthalen-2-yl-2-(oxolan-2-yl)ethanamine
CID 55104166
3-(methylamino)-3-naphthalen-2-ylpropanenitrile
CID 116955229
1-[1-(aminomethyl)cyclopropyl]-N-methyl-1-naphthalen-2-ylmethanamine
CID 116958499
2-(2,2-dimethylpyrrolidin-1-yl)-1-(3-methoxyphenyl)ethanamine
CID 55161156
N,3-dimethyl-1-naphthalen-2-ylpentan-1-amine
CID 62716073

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The IUPAC name of 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine (CID 63219539) is 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine.
What is the SMILES notation for 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The canonical SMILES for 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine is CNC(CN1CCCC1(C)C)c1ccc2ccccc2c1.
What is the InChIKey of 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
The InChIKey is DIBWXVTWXFSLNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-19(2)11-6-12-21(19)14-18(20-3)17-10-9-15-7-4-5-8-16(15)13-17/h4-5,7-10,13,18,20H,6,11-12,14H2,1-3H3.
What are the key properties of 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine?
2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine has a molecular weight of 282.43 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-naphthalen-2-ylethanamine is sourced from PubChem (CID 63219539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).