N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide

C12H15N3OS — CID 35520802

IUPACN-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide
SMILESCCn1nccc1CN(C)C(=O)c1cccs1
InChIInChI=1S/C12H15N3OS/c1-3-15-10(6-7-13-15)9-14(2)12(16)11-5-4-8-17-11/h4-8H,3,9H2,1-2H3
InChIKeyRUHVRHLFDDQPIU-UHFFFAOYSA-N
MW249.34 g/mol
LogP2.24
Rot. Bonds4

About N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide

N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide (PubChem CID 35520802) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide
PubChem CID35520802
Molecular FormulaC12H15N3OS
Molecular Weight249.34 g/mol
Exact Mass249.09
IUPAC NameN-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide
SMILESCCn1nccc1CN(C)C(=O)c1cccs1
InChIInChI=1S/C12H15N3OS/c1-3-15-10(6-7-13-15)9-14(2)12(16)11-5-4-8-17-11/h4-8H,3,9H2,1-2H3
InChIKeyRUHVRHLFDDQPIU-UHFFFAOYSA-N
XLogP2.24
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-7-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19454409
4-N-[(2-ethylpyrazol-3-yl)methyl]-4-N-methylbenzene-1,4-dicarboxamide
CID 122143622
N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
CID 19454265
N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-4-[(3-methylphenoxy)methyl]thiophene-2-carboxamide
CID 19491225
N-[(2-ethylpyrazol-3-yl)methyl]-N,1-dimethylpyrazole-3-carboxamide
CID 19278025
N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-2-phenylacetamide
CID 19454252
4-[(3,4-dimethylphenoxy)methyl]-N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide
CID 19471966
N-(furan-3-ylmethyl)-N-methylthiophene-2-carboxamide
CID 61151068
1-ethyl-N-[(2-ethylpyrazol-3-yl)methyl]-N,3-dimethylpyrazole-4-carboxamide
CID 19477847
5-chloro-N-[(2-ethylpyrazol-3-yl)methyl]-2-methoxy-N-methylbenzamide
CID 19454392
CID 69258575
CID 69258575
N-[(2-ethylpyrazol-3-yl)methyl]-N-methyl-3-(2,2,2-trifluoroethoxy)benzamide
CID 19454355

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide?
The IUPAC name of N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide (CID 35520802) is N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide?
The canonical SMILES for N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide is CCn1nccc1CN(C)C(=O)c1cccs1.
What is the InChIKey of N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide?
The InChIKey is RUHVRHLFDDQPIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3OS/c1-3-15-10(6-7-13-15)9-14(2)12(16)11-5-4-8-17-11/h4-8H,3,9H2,1-2H3.
What are the key properties of N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide?
N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide has a molecular weight of 249.34 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethylpyrazol-3-yl)methyl]-N-methylthiophene-2-carboxamide is sourced from PubChem (CID 35520802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).