4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide

C12H14N2O3S — CID 97260854

IUPAC4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide
SMILESCOc1csc(C(=O)N[C@@H](C)c2ncc(C)o2)c1
InChIInChI=1S/C12H14N2O3S/c1-7-5-13-12(17-7)8(2)14-11(15)10-4-9(16-3)6-18-10/h4-6,8H,1-3H3,(H,14,15)/t8-/m0/s1
InChIKeyDOXKRSRBLMNNPA-QMMMGPOBSA-N
MW266.32 g/mol
LogP2.54
Rot. Bonds4

About 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide

4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide (PubChem CID 97260854) has the molecular formula C12H14N2O3S and a molecular weight of 266.32 g/mol. Its IUPAC name is 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide
PubChem CID97260854
Molecular FormulaC12H14N2O3S
Molecular Weight266.32 g/mol
Exact Mass266.07
IUPAC Name4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide
SMILESCOc1csc(C(=O)N[C@@H](C)c2ncc(C)o2)c1
InChIInChI=1S/C12H14N2O3S/c1-7-5-13-12(17-7)8(2)14-11(15)10-4-9(16-3)6-18-10/h4-6,8H,1-3H3,(H,14,15)/t8-/m0/s1
InChIKeyDOXKRSRBLMNNPA-QMMMGPOBSA-N
XLogP2.54
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.32
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-4-methoxy-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzamide
CID 106388368
3-amino-3-methyl-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]butanamide
CID 106388299
5-methoxy-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]pyrimidin-2-amine
CID 106388852
N-(4-hydroxybutan-2-yl)-4-methoxythiophene-2-carboxamide
CID 115283653
4-[1-(5-methyl-1,3-oxazol-2-yl)ethylcarbamoyl]pyridine-2-carboxylic acid
CID 106389570
N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-2-sulfanylacetamide
CID 106390070
3-amino-2-methoxy-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]benzamide
CID 106387458
3-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-3-sulfanylidenepropanamide
CID 106388530
5-amino-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,3,4-thiadiazole-2-carboxamide
CID 106389790
2-(2-aminoethyl)-N-[1-(5-methyl-1,3-oxazol-2-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 106388301
N-(2-hydroxypropyl)-4-methoxythiophene-2-carboxamide
CID 81121281
N-(1-amino-3-methyl-1-sulfanylidenebutan-2-yl)-4-methoxythiophene-2-carboxamide
CID 81121736

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide?
The IUPAC name of 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide (CID 97260854) is 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide?
The canonical SMILES for 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide is COc1csc(C(=O)N[C@@H](C)c2ncc(C)o2)c1.
What is the InChIKey of 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide?
The InChIKey is DOXKRSRBLMNNPA-QMMMGPOBSA-N. The full InChI is InChI=1S/C12H14N2O3S/c1-7-5-13-12(17-7)8(2)14-11(15)10-4-9(16-3)6-18-10/h4-6,8H,1-3H3,(H,14,15)/t8-/m0/s1.
What are the key properties of 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide?
4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide has a molecular weight of 266.32 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(1S)-1-(5-methyl-1,3-oxazol-2-yl)ethyl]thiophene-2-carboxamide is sourced from PubChem (CID 97260854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).