N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide

C10H8N4OS — CID 166222045

IUPACN-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cc2sccc2[nH]1
InChIInChI=1S/C10H8N4OS/c15-10(13-6-4-11-12-5-6)8-3-9-7(14-8)1-2-16-9/h1-5,14H,(H,11,12)(H,13,15)
InChIKeyQQYVTTMBDUVJEI-UHFFFAOYSA-N
MW232.27 g/mol
LogP2.20
Rot. Bonds2

About N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide

N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide (PubChem CID 166222045) has the molecular formula C10H8N4OS and a molecular weight of 232.27 g/mol. Its IUPAC name is N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide.

Molecular Properties

Compound NameN-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide
PubChem CID166222045
Molecular FormulaC10H8N4OS
Molecular Weight232.27 g/mol
Exact Mass232.04
IUPAC NameN-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide
SMILESO=C(Nc1cn[nH]c1)c1cc2sccc2[nH]1
InChIInChI=1S/C10H8N4OS/c15-10(13-6-4-11-12-5-6)8-3-9-7(14-8)1-2-16-9/h1-5,14H,(H,11,12)(H,13,15)
InChIKeyQQYVTTMBDUVJEI-UHFFFAOYSA-N
XLogP2.20
TPSA73.57 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.27
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 166228868
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CID 166293879
N-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 53486940
4-hydroxy-N-(1H-pyrazol-4-yl)benzamide
CID 43540288
N'-(2-methylpropanoyl)-4H-thieno[3,2-b]pyrrole-5-carbohydrazide
CID 146308203
N-(2-prop-2-enoyl-1,3-dihydroisoindol-5-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide
CID 172888040
4-methoxy-N-(1H-pyrazol-4-yl)benzamide
CID 43429414
1H-pyrazol-4-ylcarbamic acid
CID 66846919
1H-pyrazol-4-ylcarbamic acid
CID 66846920
3,4-dimethyl-N-(1H-pyrazol-4-yl)benzamide
CID 43429529
3-[4-(1H-pyrazol-4-ylcarbamoyl)thiophen-2-yl]prop-2-enoic acid
CID 79684085
6-chloro-N-(1H-pyrazol-4-yl)pyridazine-3-carboxamide
CID 60859843

Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide?
The IUPAC name of N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide (CID 166222045) is N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide.
What is the SMILES notation for N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide?
The canonical SMILES for N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide is O=C(Nc1cn[nH]c1)c1cc2sccc2[nH]1.
What is the InChIKey of N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide?
The InChIKey is QQYVTTMBDUVJEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4OS/c15-10(13-6-4-11-12-5-6)8-3-9-7(14-8)1-2-16-9/h1-5,14H,(H,11,12)(H,13,15).
What are the key properties of N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide?
N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide has a molecular weight of 232.27 g/mol, XLogP of 2.20, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrazol-4-yl)-4H-thieno[3,2-b]pyrrole-5-carboxamide is sourced from PubChem (CID 166222045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).