N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide

C18H14N4O3S — CID 134037519

IUPACN-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide
SMILESCc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C18H14N4O3S/c1-10-7-15(21-17(23)14-3-2-6-25-14)26-16(10)18(24)20-12-4-5-13-11(8-12)9-19-22-13/h2-9H,1H3,(H,19,22)(H,20,24)(H,21,23)
InChIKeyOCPDVIVRQRVUNR-UHFFFAOYSA-N
MW366.40 g/mol
LogP4.03
Rot. Bonds4

About N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide

N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide (PubChem CID 134037519) has the molecular formula C18H14N4O3S and a molecular weight of 366.40 g/mol. Its IUPAC name is N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide
PubChem CID134037519
Molecular FormulaC18H14N4O3S
Molecular Weight366.40 g/mol
Exact Mass366.08
IUPAC NameN-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide
SMILESCc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccc2[nH]ncc2c1
InChIInChI=1S/C18H14N4O3S/c1-10-7-15(21-17(23)14-3-2-6-25-14)26-16(10)18(24)20-12-4-5-13-11(8-12)9-19-22-13/h2-9H,1H3,(H,19,22)(H,20,24)(H,21,23)
InChIKeyOCPDVIVRQRVUNR-UHFFFAOYSA-N
XLogP4.03
TPSA100.02 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.40
LogP ≤ 54.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1H-indazol-6-yl)furan-2-carboxamide
CID 3613849
N-(6-methyl-1H-indazol-5-yl)furan-2-carboxamide
CID 1481970
N-(1H-indazol-4-yl)furan-2-carboxamide
CID 1482885
1-(furan-2-carbonyl)-N-(1H-indazol-5-yl)piperidine-4-carboxamide
CID 60372229
N-[3-(1-benzothiophen-2-yl)-4-fluoro-1H-indazol-5-yl]furan-2-carboxamide
CID 23589919
N-[3-(1-benzothiophen-2-yl)-6-fluoro-1H-indazol-5-yl]furan-2-carboxamide
CID 23589928
N-[6-fluoro-3-[(E)-2-thiophen-2-ylethenyl]-1H-indazol-5-yl]furan-2-carboxamide
CID 59797208
2-N-[6-fluoro-3-[(E)-2-thiophen-2-ylethenyl]-1H-indazol-5-yl]-5-N-methylfuran-2,5-dicarboxamide
CID 60034750
5-N-[6-fluoro-3-[(E)-2-thiophen-2-ylethenyl]-1H-indazol-5-yl]-2-N,2-N-dimethylfuran-2,5-dicarboxamide
CID 60034996
2-N-[6-fluoro-3-[(E)-2-thiophen-2-ylethenyl]-1H-indazol-5-yl]furan-2,5-dicarboxamide
CID 60035147
N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]furan-2-carboxamide
CID 72564535
2-N-[6-fluoro-3-(2-thiophen-2-ylethenyl)-1H-indazol-5-yl]-5-N-methylfuran-2,5-dicarboxamide
CID 72628121

Frequently Asked Questions

What is the IUPAC name of N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide?
The IUPAC name of N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide (CID 134037519) is N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide is Cc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccc2[nH]ncc2c1.
What is the InChIKey of N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide?
The InChIKey is OCPDVIVRQRVUNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N4O3S/c1-10-7-15(21-17(23)14-3-2-6-25-14)26-16(10)18(24)20-12-4-5-13-11(8-12)9-19-22-13/h2-9H,1H3,(H,19,22)(H,20,24)(H,21,23).
What are the key properties of N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide?
N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide has a molecular weight of 366.40 g/mol, XLogP of 4.03, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1H-indazol-5-ylcarbamoyl)-4-methylthiophen-2-yl]furan-2-carboxamide is sourced from PubChem (CID 134037519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).