1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine

C18H25N3 — CID 63163943

IUPAC1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine
SMILESCN(C)C1CCN(CC(N)c2cccc3ccccc23)C1
InChIInChI=1S/C18H25N3/c1-20(2)15-10-11-21(12-15)13-18(19)17-9-5-7-14-6-3-4-8-16(14)17/h3-9,15,18H,10-13,19H2,1-2H3
InChIKeyHIAIQZLLJRQNJU-UHFFFAOYSA-N
MW283.42 g/mol
LogP2.48
Rot. Bonds4

About 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine

1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine (PubChem CID 63163943) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine
PubChem CID63163943
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC Name1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine
SMILESCN(C)C1CCN(CC(N)c2cccc3ccccc23)C1
InChIInChI=1S/C18H25N3/c1-20(2)15-10-11-21(12-15)13-18(19)17-9-5-7-14-6-3-4-8-16(14)17/h3-9,15,18H,10-13,19H2,1-2H3
InChIKeyHIAIQZLLJRQNJU-UHFFFAOYSA-N
XLogP2.48
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-amino-2-[2-(trifluoromethyl)phenyl]ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 107521048
2-(4-ethylpiperidin-1-yl)-1-naphthalen-1-ylethanamine
CID 61420704
1-[2-[3-(dimethylamino)pyrrolidin-1-yl]-1-naphthalen-1-ylethyl]cyclohexan-1-ol
CID 72758154
1-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63164076
1-[2-amino-2-(4-fluorophenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 107521053
1-[2-amino-2-(2,5-dimethoxyphenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63163900
2-[3-(dimethylamino)pyrrolidin-1-yl]-1-(2-methylphenyl)ethanol
CID 55159139
N,N-dimethyl-1-[2-(methylamino)-2-phenylethyl]pyrrolidin-3-amine
CID 63164036
N'-(3-amino-3-naphthalen-1-ylpropyl)-N'-methyl-1-naphthalen-1-ylpropane-1,3-diamine
CID 57188438
1-[2-amino-2-(4-propan-2-yloxyphenyl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63164252
1-[3-amino-3-(2-fluorophenyl)-2-methylpropyl]-N,N-dimethylpiperidin-3-amine
CID 115996985
1-[2-amino-2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-N,N-dimethylpyrrolidin-3-amine
CID 63163944

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine (CID 63163943) is 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine is CN(C)C1CCN(CC(N)c2cccc3ccccc23)C1.
What is the InChIKey of 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine?
The InChIKey is HIAIQZLLJRQNJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-20(2)15-10-11-21(12-15)13-18(19)17-9-5-7-14-6-3-4-8-16(14)17/h3-9,15,18H,10-13,19H2,1-2H3.
What are the key properties of 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine?
1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine has a molecular weight of 283.42 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-naphthalen-1-ylethyl)-N,N-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 63163943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).