N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide

C10H10N2OS — CID 71684218

IUPACN-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCc1ccc[nH]1)c1cccs1
InChIInChI=1S/C10H10N2OS/c13-10(9-4-2-6-14-9)12-7-8-3-1-5-11-8/h1-6,11H,7H2,(H,12,13)
InChIKeySHIVANNFTVUTHE-UHFFFAOYSA-N
MW206.27 g/mol
LogP2.01
Rot. Bonds3

About N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide

N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide (PubChem CID 71684218) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide
PubChem CID71684218
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC NameN-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide
SMILESO=C(NCc1ccc[nH]1)c1cccs1
InChIInChI=1S/C10H10N2OS/c13-10(9-4-2-6-14-9)12-7-8-3-1-5-11-8/h1-6,11H,7H2,(H,12,13)
InChIKeySHIVANNFTVUTHE-UHFFFAOYSA-N
XLogP2.01
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N,N'-bis(1H-pyrrol-2-ylmethyl)oxamide
CID 126500406
N-benzylthiophene-2-carboxamide
CID 574227
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CID 25105717
N-(1H-benzimidazol-2-ylmethyl)thiophene-2-carboxamide
CID 751095
N-[(3-bromothiophen-2-yl)methyl]thiophene-2-carboxamide
CID 78985953
N-(1H-1,2,4-triazol-5-ylmethyl)thiophene-2-carboxamide
CID 60982202
N-(2-aminoethyl)thiophene-2-carboxamide
CID 4649097
N'-(1H-pyrrol-2-ylmethyl)oxamide
CID 115191836
N-(naphthalen-1-ylmethyl)thiophene-2-carboxamide
CID 25105722
2-methyl-N-(1H-pyrrol-2-ylmethyl)propanamide
CID 110374909
N-[2-(carbamoylamino)ethyl]thiophene-2-carboxamide
CID 115282462
N-[[4-(thiophen-3-ylmethylcarbamoyl)phenyl]methyl]thiophene-2-carboxamide
CID 55766242

Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide?
The IUPAC name of N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide (CID 71684218) is N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide?
The canonical SMILES for N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide is O=C(NCc1ccc[nH]1)c1cccs1.
What is the InChIKey of N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide?
The InChIKey is SHIVANNFTVUTHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS/c13-10(9-4-2-6-14-9)12-7-8-3-1-5-11-8/h1-6,11H,7H2,(H,12,13).
What are the key properties of N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide?
N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide has a molecular weight of 206.27 g/mol, XLogP of 2.01, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrrol-2-ylmethyl)thiophene-2-carboxamide is sourced from PubChem (CID 71684218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).