1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide

C15H18N4O — CID 103000781

IUPAC1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1c1ccnc2cc(N)ccc12
InChIInChI=1S/C15H18N4O/c1-17-15(20)14-3-2-8-19(14)13-6-7-18-12-9-10(16)4-5-11(12)13/h4-7,9,14H,2-3,8,16H2,1H3,(H,17,20)
InChIKeyPECODIMBEHNFON-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.53
Rot. Bonds2

About 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide

1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide (PubChem CID 103000781) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide
PubChem CID103000781
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1c1ccnc2cc(N)ccc12
InChIInChI=1S/C15H18N4O/c1-17-15(20)14-3-2-8-19(14)13-6-7-18-12-9-10(16)4-5-11(12)13/h4-7,9,14H,2-3,8,16H2,1H3,(H,17,20)
InChIKeyPECODIMBEHNFON-UHFFFAOYSA-N
XLogP1.53
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-(2-cyclopentylpyrrolidin-1-yl)quinolin-7-amine
CID 103000935
1-(8-aminoquinolin-4-yl)-N-methylpiperidine-2-carboxamide
CID 83065847
1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide
CID 104540139
(2S)-1-(7-bromoquinolin-4-yl)pyrrolidine-2-carboxylic acid
CID 122059764
1-(7-bromoquinolin-4-yl)pyrrolidine-2-carboxylic acid
CID 122058852
1-(3,4-diaminophenyl)-N-methylpyrrolidine-2-carboxamide
CID 106750593
1-(7-bromoquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 133331225
1-(7-chloroquinolin-4-yl)-N,N-dimethylpyrrolidine-2-carboxamide
CID 134032257
1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80904751
1-(3-amino-4-pyridinyl)-N-methylpiperidine-2-carboxamide
CID 54985518
1-(2-amino-5-carbamoylphenyl)-N-methylpyrrolidine-2-carboxamide
CID 63356602
1-[2-amino-5-(methylcarbamoyl)phenyl]-N-methylpyrrolidine-2-carboxamide
CID 63357045

Frequently Asked Questions

What is the IUPAC name of 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide (CID 103000781) is 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide is CNC(=O)C1CCCN1c1ccnc2cc(N)ccc12.
What is the InChIKey of 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide?
The InChIKey is PECODIMBEHNFON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-17-15(20)14-3-2-8-19(14)13-6-7-18-12-9-10(16)4-5-11(12)13/h4-7,9,14H,2-3,8,16H2,1H3,(H,17,20).
What are the key properties of 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide?
1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 103000781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).