(3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone

C10H13NO3S — CID 130588023

IUPAC(3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone
SMILESCOc1ccc(C(=O)C2(N)CCOC2)s1
InChIInChI=1S/C10H13NO3S/c1-13-8-3-2-7(15-8)9(12)10(11)4-5-14-6-10/h2-3H,4-6,11H2,1H3
InChIKeySJNSRWYJXIFUGL-UHFFFAOYSA-N
MW227.28 g/mol
LogP1.06
Rot. Bonds3

About (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone

(3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone (PubChem CID 130588023) has the molecular formula C10H13NO3S and a molecular weight of 227.28 g/mol. Its IUPAC name is (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone.

Molecular Properties

Compound Name(3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone
PubChem CID130588023
Molecular FormulaC10H13NO3S
Molecular Weight227.28 g/mol
Exact Mass227.06
IUPAC Name(3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone
SMILESCOc1ccc(C(=O)C2(N)CCOC2)s1
InChIInChI=1S/C10H13NO3S/c1-13-8-3-2-7(15-8)9(12)10(11)4-5-14-6-10/h2-3H,4-6,11H2,1H3
InChIKeySJNSRWYJXIFUGL-UHFFFAOYSA-N
XLogP1.06
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.28
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-aminooxolan-3-yl)-(3-methoxypyrazin-2-yl)methanone
CID 116579533
1-(3-aminooxolan-3-yl)ethanone
CID 59621130
(3-aminooxolan-3-yl)-(4-phenylphenyl)methanone
CID 116579512
(3S)-3-aminooxolane-3-carboxamide
CID 96640573
2-[(3-aminooxolane-3-carbonyl)amino]-4-methoxybenzoic acid
CID 115411627
(4-aminooxan-4-yl)-(4-methoxy-2-methylphenyl)methanone
CID 116604665
(4-methoxyphenyl)methyl 4-aminooxane-4-carboxylate
CID 115292702
3-amino-N-[4-(methylcarbamoylamino)phenyl]oxolane-3-carboxamide
CID 64892532
1-(3-aminooxolan-3-yl)-2-(2-methoxy-5-methylphenyl)ethanone
CID 116579688
3-amino-N-[cyclopropyl-(4-methoxyphenyl)methyl]oxolane-3-carboxamide
CID 64891982
1-(3-aminooxolan-3-yl)-2,2-dimethylpropan-1-one
CID 116579625
3-amino-N-(2-methoxy-3-pyridinyl)oxolane-3-carboxamide
CID 64891921

Frequently Asked Questions

What is the IUPAC name of (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone?
The IUPAC name of (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone (CID 130588023) is (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone.
What is the SMILES notation for (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone?
The canonical SMILES for (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone is COc1ccc(C(=O)C2(N)CCOC2)s1.
What is the InChIKey of (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone?
The InChIKey is SJNSRWYJXIFUGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3S/c1-13-8-3-2-7(15-8)9(12)10(11)4-5-14-6-10/h2-3H,4-6,11H2,1H3.
What are the key properties of (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone?
(3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone has a molecular weight of 227.28 g/mol, XLogP of 1.06, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-aminooxolan-3-yl)-(5-methoxythiophen-2-yl)methanone is sourced from PubChem (CID 130588023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).