(3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone

C14H17N3OS — CID 114289208

IUPAC(3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
SMILESCCC1CCCN1C(=O)c1sc2cnccc2c1N
InChIInChI=1S/C14H17N3OS/c1-2-9-4-3-7-17(9)14(18)13-12(15)10-5-6-16-8-11(10)19-13/h5-6,8-9H,2-4,7,15H2,1H3
InChIKeyICRSPRNVEWCGEX-UHFFFAOYSA-N
MW275.38 g/mol
LogP2.89
Rot. Bonds2

About (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone

(3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone (PubChem CID 114289208) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
PubChem CID114289208
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC Name(3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
SMILESCCC1CCCN1C(=O)c1sc2cnccc2c1N
InChIInChI=1S/C14H17N3OS/c1-2-9-4-3-7-17(9)14(18)13-12(15)10-5-6-16-8-11(10)19-13/h5-6,8-9H,2-4,7,15H2,1H3
InChIKeyICRSPRNVEWCGEX-UHFFFAOYSA-N
XLogP2.89
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylazepan-1-yl)methanone
CID 104692785
(3-amino-5-bromo-1-benzothiophen-2-yl)-(2-ethylpyrrolidin-1-yl)methanone
CID 114896462
2,3,3a,4,5,6,7,7a-octahydroindol-1-yl-(3-aminothieno[2,3-c]pyridin-2-yl)methanone
CID 82752576
(2-ethylpyrrolidin-1-yl)-[3-(methylamino)-4-pyridinyl]methanone
CID 105067784
(2-ethylpyrrolidin-1-yl)-pyridin-4-ylmethanone
CID 84514744
(3-aminothieno[2,3-c]pyridin-2-yl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 114289114
1-(3-aminothieno[2,3-c]pyridin-2-yl)butan-1-one
CID 58826843
(2-ethylpiperidin-1-yl)-(4-methyl-3-pyridinyl)methanone
CID 110855901
(3-aminothieno[2,3-c]pyridin-2-yl)-(4-methyl-1,4-diazepan-1-yl)methanone
CID 114289131
(2-ethylazepan-1-yl)-[3-(methylamino)-4-pyridinyl]methanone
CID 105071156
(5-aminothieno[2,3-c]pyridazin-6-yl)-(2-propan-2-ylpyrrolidin-1-yl)methanone
CID 80519226
(3-amino-5-bromo-1-benzothiophen-2-yl)-[2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 114896482

Frequently Asked Questions

What is the IUPAC name of (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone?
The IUPAC name of (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone (CID 114289208) is (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone?
The canonical SMILES for (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone is CCC1CCCN1C(=O)c1sc2cnccc2c1N.
What is the InChIKey of (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone?
The InChIKey is ICRSPRNVEWCGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-2-9-4-3-7-17(9)14(18)13-12(15)10-5-6-16-8-11(10)19-13/h5-6,8-9H,2-4,7,15H2,1H3.
What are the key properties of (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone?
(3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone has a molecular weight of 275.38 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminothieno[2,3-c]pyridin-2-yl)-(2-ethylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 114289208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).