3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide

C15H21N3O3 — CID 95820731

IUPAC3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide
SMILESCOCC(=O)N1CCC[C@@H]1c1cccc(CCC(N)=O)n1
InChIInChI=1S/C15H21N3O3/c1-21-10-15(20)18-9-3-6-13(18)12-5-2-4-11(17-12)7-8-14(16)19/h2,4-5,13H,3,6-10H2,1H3,(H2,16,19)/t13-/m1/s1
InChIKeyGARHCWVECJQPDB-CYBMUJFWSA-N
MW291.35 g/mol
LogP0.81
Rot. Bonds6

About 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide

3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide (PubChem CID 95820731) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide.

Molecular Properties

Compound Name3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide
PubChem CID95820731
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC Name3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide
SMILESCOCC(=O)N1CCC[C@@H]1c1cccc(CCC(N)=O)n1
InChIInChI=1S/C15H21N3O3/c1-21-10-15(20)18-9-3-6-13(18)12-5-2-4-11(17-12)7-8-14(16)19/h2,4-5,13H,3,6-10H2,1H3,(H2,16,19)/t13-/m1/s1
InChIKeyGARHCWVECJQPDB-CYBMUJFWSA-N
XLogP0.81
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[6-[(2S)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-methylpyrimidin-4-yl]propanamide
CID 95826823
1-[2-(6-benzyl-2-pyridinyl)pyrrolidin-1-yl]-2-methoxyethanone
CID 110254541
3-[6-[1-[(2-methoxypyrimidin-5-yl)methyl]pyrrolidin-2-yl]-2-pyridinyl]propanamide
CID 110255862
1-[(2S)-2-[6-[(2-chlorophenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]-2-methoxyethanone
CID 95818099
3-[6-(1-acetylpyrrolidin-2-yl)-2-pyridinyl]-N-methylpropanamide
CID 110269727
3-[6-[1-[(3,5-difluorophenyl)methyl]pyrrolidin-2-yl]-2-pyridinyl]propanamide
CID 110255864
3-methoxy-1-[(2S)-2-[6-(morpholin-4-ylmethyl)-2-pyridinyl]pyrrolidin-1-yl]propan-1-one
CID 124978104
1-[2-(2-aminopyrimidin-4-yl)piperidin-1-yl]-2-methoxyethanone
CID 110269315
2-methoxy-1-[2-[6-(2-propan-2-ylpyrazol-3-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 110101896
N-[[6-[1-(3-cyclohexylpropanoyl)pyrrolidin-2-yl]-2-pyridinyl]methyl]acetamide
CID 110095780
1-[2-[6-[(4-fluorophenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]-3-(4-methoxyphenyl)propan-1-one
CID 110254562
N-[[6-[(2R)-1-(3-thiophen-2-ylpropanoyl)pyrrolidin-2-yl]-2-pyridinyl]methyl]acetamide
CID 124963053

Frequently Asked Questions

What is the IUPAC name of 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide?
The IUPAC name of 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide (CID 95820731) is 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide.
What is the SMILES notation for 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide?
The canonical SMILES for 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide is COCC(=O)N1CCC[C@@H]1c1cccc(CCC(N)=O)n1.
What is the InChIKey of 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide?
The InChIKey is GARHCWVECJQPDB-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H21N3O3/c1-21-10-15(20)18-9-3-6-13(18)12-5-2-4-11(17-12)7-8-14(16)19/h2,4-5,13H,3,6-10H2,1H3,(H2,16,19)/t13-/m1/s1.
What are the key properties of 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide?
3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide has a molecular weight of 291.35 g/mol, XLogP of 0.81, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-[(2R)-1-(2-methoxyacetyl)pyrrolidin-2-yl]-2-pyridinyl]propanamide is sourced from PubChem (CID 95820731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).