1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide

C11H16N4O — CID 104540139

IUPAC1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1c1cccnc1N
InChIInChI=1S/C11H16N4O/c1-13-11(16)9-5-3-7-15(9)8-4-2-6-14-10(8)12/h2,4,6,9H,3,5,7H2,1H3,(H2,12,14)(H,13,16)
InChIKeyAFLHJQXEASZTBI-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.38
Rot. Bonds2

About 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide

1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide (PubChem CID 104540139) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide
PubChem CID104540139
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide
SMILESCNC(=O)C1CCCN1c1cccnc1N
InChIInChI=1S/C11H16N4O/c1-13-11(16)9-5-3-7-15(9)8-4-2-6-14-10(8)12/h2,4,6,9H,3,5,7H2,1H3,(H2,12,14)(H,13,16)
InChIKeyAFLHJQXEASZTBI-UHFFFAOYSA-N
XLogP0.38
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(7-aminoquinolin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 103000781
1-(2-hydrazinylpyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80904751
1-(3-amino-4-pyridinyl)-N-methylpiperidine-2-carboxamide
CID 54985518
1-(8-aminoquinolin-4-yl)-N-methylpiperidine-2-carboxamide
CID 83065847
1-[2-amino-5-(methylcarbamoyl)phenyl]-N-methylpyrrolidine-2-carboxamide
CID 63357045
1-(2-amino-5-carbamoylphenyl)-N-methylpyrrolidine-2-carboxamide
CID 63356602
1-(2-amino-3-sulfamoylphenyl)-N-methylpiperidine-2-carboxamide
CID 115992520
1-(3,4-diaminophenyl)-N-methylpyrrolidine-2-carboxamide
CID 106750593
1-(2-amino-4-fluoro-5-methylphenyl)-N-methylpyrrolidine-2-carboxamide
CID 103590158
1-(5-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide
CID 104533673
1-(5-aminopyrazin-2-yl)-N-methylpiperidine-2-carboxamide
CID 80653622
1-(6-amino-5-nitropyrimidin-4-yl)-N-methylpyrrolidine-2-carboxamide
CID 80806765

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide?
The IUPAC name of 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide (CID 104540139) is 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide is CNC(=O)C1CCCN1c1cccnc1N.
What is the InChIKey of 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide?
The InChIKey is AFLHJQXEASZTBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-13-11(16)9-5-3-7-15(9)8-4-2-6-14-10(8)12/h2,4,6,9H,3,5,7H2,1H3,(H2,12,14)(H,13,16).
What are the key properties of 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide?
1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide has a molecular weight of 220.28 g/mol, XLogP of 0.38, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-3-pyridinyl)-N-methylpyrrolidine-2-carboxamide is sourced from PubChem (CID 104540139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).