1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide

C16H20N4O — CID 83065677

IUPAC1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1CCCN1c1ccnc2c(N)cccc12
InChIInChI=1S/C16H20N4O/c1-19(2)16(21)14-7-4-10-20(14)13-8-9-18-15-11(13)5-3-6-12(15)17/h3,5-6,8-9,14H,4,7,10,17H2,1-2H3
InChIKeyFAEKMNUDEMMFAD-UHFFFAOYSA-N
MW284.36 g/mol
LogP1.87
Rot. Bonds2

About 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide

1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide (PubChem CID 83065677) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
PubChem CID83065677
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
SMILESCN(C)C(=O)C1CCCN1c1ccnc2c(N)cccc12
InChIInChI=1S/C16H20N4O/c1-19(2)16(21)14-7-4-10-20(14)13-8-9-18-15-11(13)5-3-6-12(15)17/h3,5-6,8-9,14H,4,7,10,17H2,1-2H3
InChIKeyFAEKMNUDEMMFAD-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

1-(8-aminoquinolin-4-yl)-N-methylpiperidine-2-carboxamide
CID 83065847
4-(2-methylazepan-1-yl)quinolin-8-amine
CID 83060900
(2R)-1-(3-amino-4-pyridinyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 93173237
1-(3-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 103962898
1-(7-bromoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 133331225
1-(7-chloroquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 134032257
(2S)-1-(8-chloroquinolin-4-yl)pyrrolidine-2-carboxylic acid
CID 122059656
(2S)-1-(8-methoxyquinolin-4-yl)pyrrolidine-2-carboxylic acid
CID 122059647
1-(2-amino-3-chlorophenyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 104834158
1-(8-fluoroquinolin-4-yl)piperidine-2-carboxylic acid
CID 71563719
(2S)-1-(4,5-diamino-2-chlorophenyl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 129391550
1-(5-amino-1H-pyrazol-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 82234963

Frequently Asked Questions

What is the IUPAC name of 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide (CID 83065677) is 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide is CN(C)C(=O)C1CCCN1c1ccnc2c(N)cccc12.
What is the InChIKey of 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
The InChIKey is FAEKMNUDEMMFAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-19(2)16(21)14-7-4-10-20(14)13-8-9-18-15-11(13)5-3-6-12(15)17/h3,5-6,8-9,14H,4,7,10,17H2,1-2H3.
What are the key properties of 1-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide?
1-(8-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-(8-aminoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide is sourced from PubChem (CID 83065677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).