4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide

C10H14N2O2S — CID 80717145

IUPAC4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide
SMILESCc1sc(C(=O)NC2CCOC2)cc1N
InChIInChI=1S/C10H14N2O2S/c1-6-8(11)4-9(15-6)10(13)12-7-2-3-14-5-7/h4,7H,2-3,5,11H2,1H3,(H,12,13)
InChIKeyUHOGSWWPFJZWED-UHFFFAOYSA-N
MW226.30 g/mol
LogP1.16
Rot. Bonds2

About 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide

4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide (PubChem CID 80717145) has the molecular formula C10H14N2O2S and a molecular weight of 226.30 g/mol. Its IUPAC name is 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide.

Molecular Properties

Compound Name4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide
PubChem CID80717145
Molecular FormulaC10H14N2O2S
Molecular Weight226.30 g/mol
Exact Mass226.08
IUPAC Name4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide
SMILESCc1sc(C(=O)NC2CCOC2)cc1N
InChIInChI=1S/C10H14N2O2S/c1-6-8(11)4-9(15-6)10(13)12-7-2-3-14-5-7/h4,7H,2-3,5,11H2,1H3,(H,12,13)
InChIKeyUHOGSWWPFJZWED-UHFFFAOYSA-N
XLogP1.16
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-bromo-4-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide
CID 80712681
4-[(1S,2R)-2-aminocyclopropyl]-5-methyl-N-(oxan-4-yl)thiophene-2-carboxamide
CID 118432628
3-amino-5-bromo-2-methyl-N-(oxolan-3-yl)benzamide
CID 107872966
2-amino-4-methyl-N-(oxolan-3-yl)-1,3-thiazole-5-carboxamide
CID 80713116
2-amino-4,5-dimethoxy-N-(oxolan-3-yl)benzamide
CID 80716754
4-amino-N-(dicyclopropylmethyl)-5-methylthiophene-2-carboxamide
CID 54959114
3-amino-2,5-difluoro-N-(oxolan-3-yl)benzamide
CID 107121271
3-amino-4,6-dimethyl-N-(oxolan-3-yl)thieno[3,2-c]pyridine-2-carboxamide
CID 81052702
2-amino-4-chloro-N-(oxolan-3-yl)benzamide
CID 80717146
5-tert-butyl-N-[(3R)-oxolan-3-yl]thiophene-3-carboxamide
CID 140901140
2-methyl-N-[(3S)-oxolan-3-yl]benzamide
CID 70955221
2-methyl-N-[(3R)-oxolan-3-yl]benzamide
CID 70845923

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide?
The IUPAC name of 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide (CID 80717145) is 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide.
What is the SMILES notation for 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide?
The canonical SMILES for 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide is Cc1sc(C(=O)NC2CCOC2)cc1N.
What is the InChIKey of 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide?
The InChIKey is UHOGSWWPFJZWED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2S/c1-6-8(11)4-9(15-6)10(13)12-7-2-3-14-5-7/h4,7H,2-3,5,11H2,1H3,(H,12,13).
What are the key properties of 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide?
4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide has a molecular weight of 226.30 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-methyl-N-(oxolan-3-yl)thiophene-2-carboxamide is sourced from PubChem (CID 80717145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).