N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine

C19H16N4OS — CID 90104965

IUPACN-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
SMILESCOc1ccc2nc(Nc3ccc4c(c3)SCC4)c3[nH]ncc3c2c1
InChIInChI=1S/C19H16N4OS/c1-24-13-4-5-16-14(9-13)15-10-20-23-18(15)19(22-16)21-12-3-2-11-6-7-25-17(11)8-12/h2-5,8-10H,6-7H2,1H3,(H,20,23)(H,21,22)
InChIKeyXDKFSZVUFDCIQI-UHFFFAOYSA-N
MW348.43 g/mol
LogP4.51
Rot. Bonds3

About N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine

N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine (PubChem CID 90104965) has the molecular formula C19H16N4OS and a molecular weight of 348.43 g/mol. Its IUPAC name is N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
PubChem CID90104965
Molecular FormulaC19H16N4OS
Molecular Weight348.43 g/mol
Exact Mass348.10
IUPAC NameN-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
SMILESCOc1ccc2nc(Nc3ccc4c(c3)SCC4)c3[nH]ncc3c2c1
InChIInChI=1S/C19H16N4OS/c1-24-13-4-5-16-14(9-13)15-10-20-23-18(15)19(22-16)21-12-3-2-11-6-7-25-17(11)8-12/h2-5,8-10H,6-7H2,1H3,(H,20,23)(H,21,22)
InChIKeyXDKFSZVUFDCIQI-UHFFFAOYSA-N
XLogP4.51
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.43
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-(4-fluorophenyl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71139183
N-(4H-1,3-benzodioxin-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71138817
N-(4-benzylphenyl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71139640
6-N-(8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-yl)pyridine-2,6-diamine
CID 71138816
N-(1-tert-butylpyrazol-4-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 90104507
N-[1-(2-fluoroethyl)pyrazol-4-yl]-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 90103710
N-[6-[2-(dimethylamino)ethoxy]-3-pyridinyl]-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71139901
N-[4-[4-(cyclopropylmethyl)piperazin-1-yl]phenyl]-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71139473
N-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71139067
2-N-[2-(dimethylamino)ethyl]-5-N-(8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-yl)pyrimidine-2,5-diamine
CID 71140123
N-[2-(dimethylamino)ethyl]-4-[(8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-yl)amino]-N-methylbenzamide
CID 71139516
4-(3,4-dimethoxyanilino)-3H-pyrazolo[5,4-c]quinoline-8-carbonitrile
CID 71139125

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The IUPAC name of N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine (CID 90104965) is N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine.
What is the SMILES notation for N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The canonical SMILES for N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine is COc1ccc2nc(Nc3ccc4c(c3)SCC4)c3[nH]ncc3c2c1.
What is the InChIKey of N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The InChIKey is XDKFSZVUFDCIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4OS/c1-24-13-4-5-16-14(9-13)15-10-20-23-18(15)19(22-16)21-12-3-2-11-6-7-25-17(11)8-12/h2-5,8-10H,6-7H2,1H3,(H,20,23)(H,21,22).
What are the key properties of N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine has a molecular weight of 348.43 g/mol, XLogP of 4.51, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1-benzothiophen-6-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine is sourced from PubChem (CID 90104965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).