(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone

C19H19N3OS — CID 23943390

IUPAC(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone
SMILESNc1c(C(=O)N2CCCCC2)sc2nc(-c3ccccc3)ccc12
InChIInChI=1S/C19H19N3OS/c20-16-14-9-10-15(13-7-3-1-4-8-13)21-18(14)24-17(16)19(23)22-11-5-2-6-12-22/h1,3-4,7-10H,2,5-6,11-12,20H2
InChIKeyWKMUJMRXAXYULP-UHFFFAOYSA-N
MW337.45 g/mol
LogP4.17
Rot. Bonds2

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

(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone (PubChem CID 23943390) has the molecular formula C19H19N3OS and a molecular weight of 337.45 g/mol. Its IUPAC name is (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone
PubChem CID23943390
Molecular FormulaC19H19N3OS
Molecular Weight337.45 g/mol
Exact Mass337.12
IUPAC Name(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone
SMILESNc1c(C(=O)N2CCCCC2)sc2nc(-c3ccccc3)ccc12
InChIInChI=1S/C19H19N3OS/c20-16-14-9-10-15(13-7-3-1-4-8-13)21-18(14)24-17(16)19(23)22-11-5-2-6-12-22/h1,3-4,7-10H,2,5-6,11-12,20H2
InChIKeyWKMUJMRXAXYULP-UHFFFAOYSA-N
XLogP4.17
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 23971348
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone
CID 23999221
[3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridin-2-yl]-(3-methylpiperidin-1-yl)methanone
CID 23744160
(5-amino-4-methyl-2-phenylthieno[2,3-d]pyrimidin-6-yl)-piperidin-1-ylmethanone
CID 35177384
(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone
CID 122624340
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
N-[6-(4-chlorophenyl)-2-(piperidine-1-carbonyl)thieno[2,3-b]pyridin-3-yl]acetamide
CID 10476857
[3-amino-6-(4-methoxyphenyl)thieno[2,3-b]pyridin-2-yl]-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
CID 23831223
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(4-methylphenyl)methanone
CID 765624
(7-amino-3-phenylthieno[2,3-b]pyrazin-6-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone
CID 176733493
3,6-diamino-2-(azepane-1-carbonyl)-4-phenylthieno[2,3-b]pyridine-5-carbonitrile
CID 23744146

Frequently Asked Questions

What is the IUPAC name of (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone?
The IUPAC name of (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone (CID 23943390) is (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone is Nc1c(C(=O)N2CCCCC2)sc2nc(-c3ccccc3)ccc12.
What is the InChIKey of (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone?
The InChIKey is WKMUJMRXAXYULP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3OS/c20-16-14-9-10-15(13-7-3-1-4-8-13)21-18(14)24-17(16)19(23)22-11-5-2-6-12-22/h1,3-4,7-10H,2,5-6,11-12,20H2.
What are the key properties of (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone?
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone has a molecular weight of 337.45 g/mol, XLogP of 4.17, 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)-piperidin-1-ylmethanone is sourced from PubChem (CID 23943390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).