1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide

C11H15N3O — CID 56964987

IUPAC1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide
SMILESCN1CCCC1(C(N)=O)c1cccnc1
InChIInChI=1S/C11H15N3O/c1-14-7-3-5-11(14,10(12)15)9-4-2-6-13-8-9/h2,4,6,8H,3,5,7H2,1H3,(H2,12,15)
InChIKeyZKOROXUWDJAEJP-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.49
Rot. Bonds2

About 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide

1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide (PubChem CID 56964987) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide
PubChem CID56964987
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide
SMILESCN1CCCC1(C(N)=O)c1cccnc1
InChIInChI=1S/C11H15N3O/c1-14-7-3-5-11(14,10(12)15)9-4-2-6-13-8-9/h2,4,6,8H,3,5,7H2,1H3,(H2,12,15)
InChIKeyZKOROXUWDJAEJP-UHFFFAOYSA-N
XLogP0.49
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-2-pyrimidin-4-ylpyrrolidine-2-carboxamide
CID 118008531
1-methyl-4-pyridin-3-ylpiperidin-4-ol
CID 4172974
acetamide;3-methylpyridine;1-methylpyrrolidine
CID 143564714
3-[2-[(4-fluorophenyl)methyl]-1-methylpyrrolidin-2-yl]pyridine
CID 67821251
1-methylpyrrolidine;pyridin-3-ylurea
CID 143564599
methyl 1-pyridin-3-ylcyclobutane-1-carboxylate
CID 116963934
1,2-dimethyl-2-pyridin-3-ylpyrrolidin-3-amine
CID 112709606
1-methyl-4-phenylazepane-4-carboxamide;hydrate
CID 158339828
3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine
CID 176918775
ethyl 3-hydroxy-3-pyridin-3-ylpyrrolidine-1-carboxylate
CID 86101343
cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone
CID 95833425
ethane;3-(1-methylcyclobutyl)pyridine
CID 142353863

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide?
The IUPAC name of 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide (CID 56964987) is 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide?
The canonical SMILES for 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide is CN1CCCC1(C(N)=O)c1cccnc1.
What is the InChIKey of 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide?
The InChIKey is ZKOROXUWDJAEJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-14-7-3-5-11(14,10(12)15)9-4-2-6-13-8-9/h2,4,6,8H,3,5,7H2,1H3,(H2,12,15).
What are the key properties of 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide?
1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide has a molecular weight of 205.26 g/mol, XLogP of 0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 56964987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).