(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone

C22H17N3OS — CID 23999221

IUPAC(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone
SMILESNc1c(C(=O)N2CCc3ccccc32)sc2nc(-c3ccccc3)ccc12
InChIInChI=1S/C22H17N3OS/c23-19-16-10-11-17(14-6-2-1-3-7-14)24-21(16)27-20(19)22(26)25-13-12-15-8-4-5-9-18(15)25/h1-11H,12-13,23H2
InChIKeyIWQRLONJAUWHAA-UHFFFAOYSA-N
MW371.47 g/mol
LogP4.75
Rot. Bonds2

About (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone

(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone (PubChem CID 23999221) has the molecular formula C22H17N3OS and a molecular weight of 371.47 g/mol. Its IUPAC name is (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone.

Molecular Properties

Compound Name(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone
PubChem CID23999221
Molecular FormulaC22H17N3OS
Molecular Weight371.47 g/mol
Exact Mass371.11
IUPAC Name(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone
SMILESNc1c(C(=O)N2CCc3ccccc32)sc2nc(-c3ccccc3)ccc12
InChIInChI=1S/C22H17N3OS/c23-19-16-10-11-17(14-6-2-1-3-7-14)24-21(16)27-20(19)22(26)25-13-12-15-8-4-5-9-18(15)25/h1-11H,12-13,23H2
InChIKeyIWQRLONJAUWHAA-UHFFFAOYSA-N
XLogP4.75
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.47
LogP ≤ 54.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone
CID 23943390
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 23971348
(4-amino-1,2-thiazol-5-yl)-(2,3-dihydroindol-1-yl)methanone
CID 117218797
3-amino-N,N,6-triphenylthieno[2,3-b]pyridine-2-carboxamide
CID 23999219
3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid
CID 14113060
(3-amino-7-methoxythieno[2,3-b]quinolin-2-yl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 1374535
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(4-methylphenyl)methanone
CID 765624
(3-aminothiophen-2-yl)-(2,3-dihydroindol-1-yl)methanone
CID 61090033
(3-amino-6-pyridin-3-ylthieno[2,3-b]pyridin-2-yl)-(3,4-dihydro-2H-quinolin-1-yl)methanol
CID 138710960
5-(2,3-dihydroindole-1-carbonyl)-1,3-thiazole-4-carboxylic acid
CID 117214703
(2-amino-1,3-oxazol-4-yl)-(2,3-dihydroindol-1-yl)methanone
CID 110857028
(2-aminothiophen-3-yl)-(2,3-dihydroindol-1-yl)methanone
CID 117213470

Frequently Asked Questions

What is the IUPAC name of (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone?
The IUPAC name of (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone (CID 23999221) is (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone.
What is the SMILES notation for (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone?
The canonical SMILES for (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone is Nc1c(C(=O)N2CCc3ccccc32)sc2nc(-c3ccccc3)ccc12.
What is the InChIKey of (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone?
The InChIKey is IWQRLONJAUWHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3OS/c23-19-16-10-11-17(14-6-2-1-3-7-14)24-21(16)27-20(19)22(26)25-13-12-15-8-4-5-9-18(15)25/h1-11H,12-13,23H2.
What are the key properties of (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone?
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone has a molecular weight of 371.47 g/mol, XLogP of 4.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone is sourced from PubChem (CID 23999221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).