N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide

C17H14N4O2 — CID 665390

IUPACN-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide
SMILESCc1ccc2cc3c(NC(=O)c4ccco4)nn(C)c3nc2c1
InChIInChI=1S/C17H14N4O2/c1-10-5-6-11-9-12-15(19-17(22)14-4-3-7-23-14)20-21(2)16(12)18-13(11)8-10/h3-9H,1-2H3,(H,19,20,22)
InChIKeyKIUWXZQQDLBQQT-UHFFFAOYSA-N
MW306.33 g/mol
LogP3.28
Rot. Bonds2

About N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide

N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide (PubChem CID 665390) has the molecular formula C17H14N4O2 and a molecular weight of 306.33 g/mol. Its IUPAC name is N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide
PubChem CID665390
Molecular FormulaC17H14N4O2
Molecular Weight306.33 g/mol
Exact Mass306.11
IUPAC NameN-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide
SMILESCc1ccc2cc3c(NC(=O)c4ccco4)nn(C)c3nc2c1
InChIInChI=1S/C17H14N4O2/c1-10-5-6-11-9-12-15(19-17(22)14-4-3-7-23-14)20-21(2)16(12)18-13(11)8-10/h3-9H,1-2H3,(H,19,20,22)
InChIKeyKIUWXZQQDLBQQT-UHFFFAOYSA-N
XLogP3.28
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.33
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Mrs-1220
CID 393595
N-{3-[5-(1H-1,2,4-triazol-3-yl)-1H-indazol-3-yl]phenyl}furan-2-carboxamide
CID 22479942
Mrs1186
CID 10065929
1-[4-[3-[5-Amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]phenyl]piperazin-1-yl]-2-morpholin-4-ylethanone
CID 10311130
Propan-2-yl 4-[3-[5-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]phenyl]piperazine-1-carboxylate
CID 23570367
Tert-butyl 4-[3-[5-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]phenyl]piperazine-1-carboxylate
CID 23570387
N-[1-(2-methylpropyl)pyrazolo[3,4-b]quinolin-3-yl]furan-2-carboxamide
CID 938552
N-[3-[(2-fluorophenyl)methyl]-5-phenyltriazolo[4,5-d]pyrimidin-7-yl]furan-2-carboxamide
CID 71723578
Butyl 4-[3-[5-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]phenyl]piperazine-1-carboxylate
CID 44387827
1-[4-[3-[5-Amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]phenyl]piperazin-1-yl]-2-(2-methylmorpholin-4-yl)ethanone
CID 44387862
2-[4-[(dimethylamino)methyl]phenyl]-N-[6-(3,5-dimethylpyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimidin-4-yl]acetamide
CID 44454569
N-(6-methyl-1-propylpyrazolo[3,4-b]quinolin-3-yl)furan-2-carboxamide
CID 934278

Frequently Asked Questions

What is the IUPAC name of N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide?
The IUPAC name of N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide (CID 665390) is N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide.
What is the SMILES notation for N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide?
The canonical SMILES for N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide is Cc1ccc2cc3c(NC(=O)c4ccco4)nn(C)c3nc2c1.
What is the InChIKey of N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide?
The InChIKey is KIUWXZQQDLBQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O2/c1-10-5-6-11-9-12-15(19-17(22)14-4-3-7-23-14)20-21(2)16(12)18-13(11)8-10/h3-9H,1-2H3,(H,19,20,22).
What are the key properties of N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide?
N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide has a molecular weight of 306.33 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,7-dimethylpyrazolo[5,4-b]quinolin-3-yl)furan-2-carboxamide is sourced from PubChem (CID 665390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).