(3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone

C21H19N3OS — CID 23859675

IUPAC(3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone
SMILESCc1ccc2c(N)c(C(=O)n3c4c(c5ccccc53)CCCC4)sc2n1
InChIInChI=1S/C21H19N3OS/c1-12-10-11-15-18(22)19(26-20(15)23-12)21(25)24-16-8-4-2-6-13(16)14-7-3-5-9-17(14)24/h2,4,6,8,10-11H,3,5,7,9,22H2,1H3
InChIKeyCGJZSUFKOAUPNM-UHFFFAOYSA-N
MW361.47 g/mol
LogP4.71
Rot. Bonds1

About (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone

(3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone (PubChem CID 23859675) has the molecular formula C21H19N3OS and a molecular weight of 361.47 g/mol. Its IUPAC name is (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone.

Molecular Properties

Compound Name(3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone
PubChem CID23859675
Molecular FormulaC21H19N3OS
Molecular Weight361.47 g/mol
Exact Mass361.12
IUPAC Name(3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone
SMILESCc1ccc2c(N)c(C(=O)n3c4c(c5ccccc53)CCCC4)sc2n1
InChIInChI=1S/C21H19N3OS/c1-12-10-11-15-18(22)19(26-20(15)23-12)21(25)24-16-8-4-2-6-13(16)14-7-3-5-9-17(14)24/h2,4,6,8,10-11H,3,5,7,9,22H2,1H3
InChIKeyCGJZSUFKOAUPNM-UHFFFAOYSA-N
XLogP4.71
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.47
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone?
The IUPAC name of (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone (CID 23859675) is (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone.
What is the SMILES notation for (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone?
The canonical SMILES for (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone is Cc1ccc2c(N)c(C(=O)n3c4c(c5ccccc53)CCCC4)sc2n1.
What is the InChIKey of (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone?
The InChIKey is CGJZSUFKOAUPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3OS/c1-12-10-11-15-18(22)19(26-20(15)23-12)21(25)24-16-8-4-2-6-13(16)14-7-3-5-9-17(14)24/h2,4,6,8,10-11H,3,5,7,9,22H2,1H3.
What are the key properties of (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone?
(3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone has a molecular weight of 361.47 g/mol, XLogP of 4.71, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-6-methylthieno[2,3-b]pyridin-2-yl)-(1,2,3,4-tetrahydrocarbazol-9-yl)methanone is sourced from PubChem (CID 23859675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).