(2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone

C15H16N2OS — CID 10038899

IUPAC(2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone
SMILESCC1CCCN1C(=O)c1ccc(-c2cccs2)nc1
InChIInChI=1S/C15H16N2OS/c1-11-4-2-8-17(11)15(18)12-6-7-13(16-10-12)14-5-3-9-19-14/h3,5-7,9-11H,2,4,8H2,1H3
InChIKeyCHQVMNCJVDHLPD-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.43
Rot. Bonds2

About (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone

(2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone (PubChem CID 10038899) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone.

Molecular Properties

Compound Name(2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone
PubChem CID10038899
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC Name(2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone
SMILESCC1CCCN1C(=O)c1ccc(-c2cccs2)nc1
InChIInChI=1S/C15H16N2OS/c1-11-4-2-8-17(11)15(18)12-6-7-13(16-10-12)14-5-3-9-19-14/h3,5-7,9-11H,2,4,8H2,1H3
InChIKeyCHQVMNCJVDHLPD-UHFFFAOYSA-N
XLogP3.43
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(6-amino-3-pyridinyl)-(2-methylpyrrolidin-1-yl)methanone
CID 62151940
(6-methyl-3-pyridinyl)-[(2R)-2-methylpyrrolidin-1-yl]methanone
CID 10058742
6-thiophen-2-ylpyridine-3-carboxylic acid
CID 15411144
[6-[(2S)-2-methylpiperidine-1-carbonyl]-3-pyridinyl]-[(2R)-2-methylpiperidin-1-yl]methanone
CID 1222984
(6-methyl-3-pyridinyl)-[(2R)-2-thiophen-2-ylpyrrolidin-1-yl]methanone
CID 29284515
(1,3-dimethyl-6-thiophen-2-ylpyrazolo[5,4-b]pyridin-4-yl)-(2-methylpiperidin-1-yl)methanone
CID 44822989
[(2S)-2-methylpyrrolidin-1-yl]-(4-phenylphenyl)methanone
CID 174598087
N-(oxolan-2-ylmethyl)-6-thiophen-2-ylpyridine-3-carboxamide
CID 71830129
N'-hydroxy-6-(2-methylpyrrolidine-1-carbonyl)pyridine-3-carboximidamide
CID 77005324
1H-indazol-6-yl-(2-methylpyrrolidin-1-yl)methanone
CID 62906843
[4-(methylamino)phenyl]-(2-methylpiperidin-1-yl)methanone
CID 62170939
[4-[(2S)-2-methylpiperidine-1-carbonyl]phenyl]-phenylmethanone
CID 2532732

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone?
The IUPAC name of (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone (CID 10038899) is (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone.
What is the SMILES notation for (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone?
The canonical SMILES for (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone is CC1CCCN1C(=O)c1ccc(-c2cccs2)nc1.
What is the InChIKey of (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone?
The InChIKey is CHQVMNCJVDHLPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-11-4-2-8-17(11)15(18)12-6-7-13(16-10-12)14-5-3-9-19-14/h3,5-7,9-11H,2,4,8H2,1H3.
What are the key properties of (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone?
(2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone has a molecular weight of 272.37 g/mol, XLogP of 3.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrrolidin-1-yl)-(6-thiophen-2-yl-3-pyridinyl)methanone is sourced from PubChem (CID 10038899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).