N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide

C11H13N3OS — CID 38995701

IUPACN-(2-propylpyrazol-3-yl)thiophene-2-carboxamide
SMILESCCCn1nccc1NC(=O)c1cccs1
InChIInChI=1S/C11H13N3OS/c1-2-7-14-10(5-6-12-14)13-11(15)9-4-3-8-16-9/h3-6,8H,2,7H2,1H3,(H,13,15)
InChIKeyDXTXNCBYNJVBPE-UHFFFAOYSA-N
MW235.31 g/mol
LogP2.61
Rot. Bonds4

About N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide

N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide (PubChem CID 38995701) has the molecular formula C11H13N3OS and a molecular weight of 235.31 g/mol. Its IUPAC name is N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-propylpyrazol-3-yl)thiophene-2-carboxamide
PubChem CID38995701
Molecular FormulaC11H13N3OS
Molecular Weight235.31 g/mol
Exact Mass235.08
IUPAC NameN-(2-propylpyrazol-3-yl)thiophene-2-carboxamide
SMILESCCCn1nccc1NC(=O)c1cccs1
InChIInChI=1S/C11H13N3OS/c1-2-7-14-10(5-6-12-14)13-11(15)9-4-3-8-16-9/h3-6,8H,2,7H2,1H3,(H,13,15)
InChIKeyDXTXNCBYNJVBPE-UHFFFAOYSA-N
XLogP2.61
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]benzamide
CID 8911642
4-propoxy-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]benzamide
CID 39834768
N-(2-butylpyrazol-3-yl)-3-(thiophen-2-ylmethoxy)benzamide
CID 55674829
N-butyl-1-methyl-5-(thiophene-2-carbonylamino)pyrazole-3-carboxamide
CID 51999178
4-methoxy-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]benzamide
CID 8911601
N-[(2R)-butan-2-yl]-1-methyl-5-(thiophene-2-carbonylamino)pyrazole-3-carboxamide
CID 51999172
N-butan-2-yl-1-methyl-5-(thiophene-2-carbonylamino)pyrazole-3-carboxamide
CID 56686277
3-bromo-N-[2-(thiophen-2-ylmethyl)pyrazol-3-yl]benzamide
CID 8911637
N-[3-[[2-[(2,6-dichlorophenyl)methyl]pyrazol-3-yl]amino]-3-oxopropyl]thiophene-2-carboxamide
CID 38996537
N-(2-propylpyrazol-3-yl)-3-thiophen-3-ylpropanamide
CID 38995471
2-(2-methoxyethylamino)-N-(2-propylpyrazol-3-yl)acetamide;hydrochloride
CID 119719149
N-(4-ethoxyphenyl)-1-methyl-5-(thiophene-2-carbonylamino)pyrazole-3-carboxamide
CID 51999157

Frequently Asked Questions

What is the IUPAC name of N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide?
The IUPAC name of N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide (CID 38995701) is N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide is CCCn1nccc1NC(=O)c1cccs1.
What is the InChIKey of N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide?
The InChIKey is DXTXNCBYNJVBPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3OS/c1-2-7-14-10(5-6-12-14)13-11(15)9-4-3-8-16-9/h3-6,8H,2,7H2,1H3,(H,13,15).
What are the key properties of N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide?
N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide has a molecular weight of 235.31 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propylpyrazol-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 38995701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).