1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide

C16H20N4O — CID 103962898

IUPAC1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1CCCN1c1c(N)cnc2ccccc12
InChIInChI=1S/C16H20N4O/c1-19(2)16(21)14-8-5-9-20(14)15-11-6-3-4-7-13(11)18-10-12(15)17/h3-4,6-7,10,14H,5,8-9,17H2,1-2H3
InChIKeyMYEUYUFMCWTSCC-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.87
Rot. Bonds2

About 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide

1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide (PubChem CID 103962898) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
PubChem CID103962898
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1CCCN1c1c(N)cnc2ccccc12
InChIInChI=1S/C16H20N4O/c1-19(2)16(21)14-8-5-9-20(14)15-11-6-3-4-7-13(11)18-10-12(15)17/h3-4,6-7,10,14H,5,8-9,17H2,1-2H3
InChIKeyMYEUYUFMCWTSCC-UHFFFAOYSA-N
XLogP1.87
TPSA62.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-1-(4-methylquinazolin-2-yl)pyrrolidine-2-carboxamide
CID 45209149
1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 83065677
4-(3-aminoquinolin-4-yl)-N-methylmorpholine-3-carboxamide
CID 103963546
(2R)-1-(3-amino-4-pyridinyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 93173237
1-(3-cyanoquinolin-4-yl)pyrrolidine-2-carboxylic acid
CID 43668885
1-(5-amino-1H-pyrazol-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 82234963
1-(5-amino-3-chloro-2-pyridinyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 114046115
1-[3-(aminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidine-2-carboxamide
CID 43574359
1-(2-amino-3-chlorophenyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 104834158
1-(4-aminophenyl)-N,N-dimethylpiperidine-2-carboxamide
CID 89155190
(2S)-1-(4,5-diamino-2-chlorophenyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 129391550
1-(4,6-diamino-3-chloro-2-fluorophenyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 103552707

Frequently Asked Questions

What is the IUPAC name of 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide (CID 103962898) is 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide is CN(C)C(=O)C1CCCN1c1c(N)cnc2ccccc12.
What is the InChIKey of 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The InChIKey is MYEUYUFMCWTSCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-19(2)16(21)14-8-5-9-20(14)15-11-6-3-4-7-13(11)18-10-12(15)17/h3-4,6-7,10,14H,5,8-9,17H2,1-2H3.
What are the key properties of 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 103962898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).