N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine

C18H25N3O — CID 166327735

IUPACN,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine
SMILESCCN(CC)C1CCN(c2ccc3ccc(OC)cc3n2)C1
InChIInChI=1S/C18H25N3O/c1-4-20(5-2)15-10-11-21(13-15)18-9-7-14-6-8-16(22-3)12-17(14)19-18/h6-9,12,15H,4-5,10-11,13H2,1-3H3
InChIKeySYDJJKOMKLGZPX-UHFFFAOYSA-N
MW299.42 g/mol
LogP3.16
Rot. Bonds5

About N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine

N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine (PubChem CID 166327735) has the molecular formula C18H25N3O and a molecular weight of 299.42 g/mol. Its IUPAC name is N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine.

Molecular Properties

Compound NameN,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine
PubChem CID166327735
Molecular FormulaC18H25N3O
Molecular Weight299.42 g/mol
Exact Mass299.20
IUPAC NameN,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine
SMILESCCN(CC)C1CCN(c2ccc3ccc(OC)cc3n2)C1
InChIInChI=1S/C18H25N3O/c1-4-20(5-2)15-10-11-21(13-15)18-9-7-14-6-8-16(22-3)12-17(14)19-18/h6-9,12,15H,4-5,10-11,13H2,1-3H3
InChIKeySYDJJKOMKLGZPX-UHFFFAOYSA-N
XLogP3.16
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.42
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-(diethylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 80827694
6-[3-(diethylamino)pyrrolidin-1-yl]pyridin-3-amine
CID 55158197
1-[5-chloro-6-(methylaminomethyl)-2-pyridinyl]-N,N-diethylpyrrolidin-3-amine
CID 63168757
ethyl 1-(6-methoxyquinolin-2-yl)piperidine-4-carboxylate
CID 141431671
N,N-diethyl-1-[6-(methylaminomethyl)-2-pyridinyl]pyrrolidin-3-amine
CID 63169150
1-(6-chloropyrazin-2-yl)-N,N-diethylpyrrolidin-3-amine
CID 55158990
2-[1-(6-methoxyquinolin-2-yl)piperidin-3-yl]oxyethanol
CID 133315183
6-methoxy-2-piperidin-1-ylquinoline
CID 143398989
2-(4-cyclopropylpiperazin-1-yl)-6-methoxyquinoline;dihydrochloride
CID 11302721
1-(6-chloro-2-propan-2-ylpyrimidin-4-yl)-N,N-diethylpyrrolidin-3-amine
CID 80951646
1-[2-amino-2-(4-methoxyphenyl)ethyl]-N,N-diethylpyrrolidin-3-amine
CID 63169686
1-(2-chloro-4-pyridinyl)-N,N-diethylpyrrolidin-3-amine
CID 103757127

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine?
The IUPAC name of N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine (CID 166327735) is N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine.
What is the SMILES notation for N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine?
The canonical SMILES for N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine is CCN(CC)C1CCN(c2ccc3ccc(OC)cc3n2)C1.
What is the InChIKey of N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine?
The InChIKey is SYDJJKOMKLGZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O/c1-4-20(5-2)15-10-11-21(13-15)18-9-7-14-6-8-16(22-3)12-17(14)19-18/h6-9,12,15H,4-5,10-11,13H2,1-3H3.
What are the key properties of N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine?
N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine has a molecular weight of 299.42 g/mol, XLogP of 3.16, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-(7-methoxyquinolin-2-yl)pyrrolidin-3-amine is sourced from PubChem (CID 166327735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).