N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine

C19H16N4O2 — CID 90103568

IUPACN-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
SMILESCOc1cccc2nc(NC3=CCC4=COCC4=C3)c3[nH]ncc3c12
InChIInChI=1S/C19H16N4O2/c1-24-16-4-2-3-15-17(16)14-8-20-23-18(14)19(22-15)21-13-6-5-11-9-25-10-12(11)7-13/h2-4,6-9H,5,10H2,1H3,(H,20,23)(H,21,22)
InChIKeyOIGOLADBGSJSQU-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.66
Rot. Bonds3

About N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine

N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine (PubChem CID 90103568) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine.

Molecular Properties

Compound NameN-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
PubChem CID90103568
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC NameN-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
SMILESCOc1cccc2nc(NC3=CCC4=COCC4=C3)c3[nH]ncc3c12
InChIInChI=1S/C19H16N4O2/c1-24-16-4-2-3-15-17(16)14-8-20-23-18(14)19(22-15)21-13-6-5-11-9-25-10-12(11)7-13/h2-4,6-9H,5,10H2,1H3,(H,20,23)(H,21,22)
InChIKeyOIGOLADBGSJSQU-UHFFFAOYSA-N
XLogP3.66
TPSA72.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-tert-butylpyrazol-4-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 90103548
9-methoxy-N-[1-(2-methylprop-2-enyl)pyrazol-4-yl]-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 90103880
7,8-dimethoxy-N-(4-morpholin-4-ylphenyl)-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 70977016
N-(6-methoxy-3-pyridinyl)-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 66574661
N-(5-cyclopropyl-1H-pyrazol-3-yl)-6-methoxy-3H-pyrazolo[3,4-c]quinolin-4-amine
CID 71139819
N-(4-fluorophenyl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71139183
6-N-(8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-yl)pyridine-2,6-diamine
CID 71138816
N-(4-morpholin-4-ylphenyl)-7H-pyrazolo[5,4-c][1,5]naphthyridin-6-amine
CID 71139410
4-(3,4-dimethoxyanilino)-3H-pyrazolo[5,4-c]quinoline-8-carbonitrile
CID 71139125
N-(3,4-dimethoxyphenyl)-7-methylsulfonyl-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 90103116
N-(5-cyclopropyl-1H-1,2,4-triazol-3-yl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71139067
N-(4-benzylphenyl)-8-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine
CID 71139640

Frequently Asked Questions

What is the IUPAC name of N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The IUPAC name of N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine (CID 90103568) is N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine.
What is the SMILES notation for N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The canonical SMILES for N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine is COc1cccc2nc(NC3=CCC4=COCC4=C3)c3[nH]ncc3c12.
What is the InChIKey of N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
The InChIKey is OIGOLADBGSJSQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c1-24-16-4-2-3-15-17(16)14-8-20-23-18(14)19(22-15)21-13-6-5-11-9-25-10-12(11)7-13/h2-4,6-9H,5,10H2,1H3,(H,20,23)(H,21,22).
What are the key properties of N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine?
N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine has a molecular weight of 332.36 g/mol, XLogP of 3.66, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,7-dihydro-2-benzofuran-5-yl)-9-methoxy-3H-pyrazolo[5,4-c]quinolin-4-amine is sourced from PubChem (CID 90103568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).