(2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide

C11H14N2O3 — CID 34666491

IUPAC(2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide
SMILESCOc1ccc(NC(=O)[C@@H]2CCCO2)cn1
InChIInChI=1S/C11H14N2O3/c1-15-10-5-4-8(7-12-10)13-11(14)9-3-2-6-16-9/h4-5,7,9H,2-3,6H2,1H3,(H,13,14)/t9-/m0/s1
InChIKeyCTFCCPQUTNBXML-VIFPVBQESA-N
MW222.24 g/mol
LogP1.21
Rot. Bonds3

About (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide

(2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide (PubChem CID 34666491) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide
PubChem CID34666491
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Name(2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide
SMILESCOc1ccc(NC(=O)[C@@H]2CCCO2)cn1
InChIInChI=1S/C11H14N2O3/c1-15-10-5-4-8(7-12-10)13-11(14)9-3-2-6-16-9/h4-5,7,9H,2-3,6H2,1H3,(H,13,14)/t9-/m0/s1
InChIKeyCTFCCPQUTNBXML-VIFPVBQESA-N
XLogP1.21
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-methoxy-3-pyridinyl)-1,4-dioxane-2-carboxamide
CID 47178164
N-[6-(4-methoxyanilino)-3-pyridinyl]oxolane-2-carboxamide
CID 113019484
(2S)-N-(3,5-dimethoxyphenyl)oxolane-2-carboxamide
CID 9096652
5-[[(2S)-oxolane-2-carbonyl]amino]pyridine-2-carboxylic acid
CID 104855894
methyl 4-[[(2R)-oxolane-2-carbonyl]amino]benzoate
CID 1086797
N-[6-(ethylamino)-3-pyridinyl]oxolane-2-carboxamide
CID 115268574
(2R)-N-(3-methoxyphenyl)oxolane-2-carboxamide
CID 898392
1-cycloheptyl-3-(6-methoxy-3-pyridinyl)urea
CID 47139424
trans-(1R,2R)-N-(6-methoxy-3-pyridinyl)-2-methylcyclopropane-1-carboxamide
CID 27646060
5-methyl-N-[4-[[(2S)-oxolane-2-carbonyl]amino]phenyl]pyrazine-2-carboxamide
CID 37396639
(2R)-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]oxolane-2-carboxamide
CID 42417081
(2S)-N-(4-tert-butylphenyl)oxolane-2-carboxamide
CID 8779725

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide?
The IUPAC name of (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide (CID 34666491) is (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide is COc1ccc(NC(=O)[C@@H]2CCCO2)cn1.
What is the InChIKey of (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide?
The InChIKey is CTFCCPQUTNBXML-VIFPVBQESA-N. The full InChI is InChI=1S/C11H14N2O3/c1-15-10-5-4-8(7-12-10)13-11(14)9-3-2-6-16-9/h4-5,7,9H,2-3,6H2,1H3,(H,13,14)/t9-/m0/s1.
What are the key properties of (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide?
(2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide has a molecular weight of 222.24 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(6-methoxy-3-pyridinyl)oxolane-2-carboxamide is sourced from PubChem (CID 34666491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).