2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide

C14H20N2O4 — CID 97086861

IUPAC2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide
SMILESC[C@@H](CC[C@@H]1CCCO1)NC(=O)c1ccc(C(N)=O)o1
InChIInChI=1S/C14H20N2O4/c1-9(4-5-10-3-2-8-19-10)16-14(18)12-7-6-11(20-12)13(15)17/h6-7,9-10H,2-5,8H2,1H3,(H2,15,17)(H,16,18)/t9-,10-/m0/s1
InChIKeyLGDWSBGNVGRKLO-UWVGGRQHSA-N
MW280.32 g/mol
LogP1.46
Rot. Bonds6

About 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide

2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide (PubChem CID 97086861) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide.

Molecular Properties

Compound Name2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide
PubChem CID97086861
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Name2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide
SMILESC[C@@H](CC[C@@H]1CCCO1)NC(=O)c1ccc(C(N)=O)o1
InChIInChI=1S/C14H20N2O4/c1-9(4-5-10-3-2-8-19-10)16-14(18)12-7-6-11(20-12)13(15)17/h6-7,9-10H,2-5,8H2,1H3,(H2,15,17)(H,16,18)/t9-,10-/m0/s1
InChIKeyLGDWSBGNVGRKLO-UWVGGRQHSA-N
XLogP1.46
TPSA94.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide with MolForge

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Related Compounds

N-[2-oxo-2-[[(2S)-4-[(2S)-oxolan-2-yl]butan-2-yl]amino]ethyl]benzamide
CID 94800701
3-chloro-4-hydroxy-N-[(2S)-4-[(2S)-oxolan-2-yl]butan-2-yl]benzamide
CID 94820204
1-[(4-fluorophenyl)methyl]-1-methyl-3-[4-(oxolan-2-yl)butan-2-yl]urea
CID 60613955
N-[(2R)-4-[(2R)-oxolan-2-yl]butan-2-yl]-3-phenylfuran-2-carboxamide
CID 94798688
N-[4-(oxolan-2-yl)butan-2-yl]-3-phenylfuran-2-carboxamide
CID 47091747
5-(1-chloroethyl)-N-(oxolan-2-ylmethyl)furan-2-carboxamide
CID 82109059
N-[(2R)-4-[(2S)-oxolan-2-yl]butan-2-yl]-3H-benzimidazole-5-carboxamide
CID 94820918
N-[(2R)-4-[(2R)-oxolan-2-yl]butan-2-yl]-3H-benzimidazole-5-carboxamide
CID 94820916
1-[2-(4-methoxyphenyl)ethyl]-3-[4-(oxolan-2-yl)butan-2-yl]urea
CID 60614284
4,6-dimethyl-2-oxo-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]-1H-pyridine-3-carboxamide
CID 95906136
4-oxo-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]-2-sulfanylidene-1H-quinazoline-7-carboxamide
CID 99793491
(2S,3R)-2-methyl-N-[(2R)-4-[(2R)-oxolan-2-yl]butan-2-yl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 124733118

Frequently Asked Questions

What is the IUPAC name of 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide?
The IUPAC name of 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide (CID 97086861) is 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide.
What is the SMILES notation for 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide?
The canonical SMILES for 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide is C[C@@H](CC[C@@H]1CCCO1)NC(=O)c1ccc(C(N)=O)o1.
What is the InChIKey of 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide?
The InChIKey is LGDWSBGNVGRKLO-UWVGGRQHSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-9(4-5-10-3-2-8-19-10)16-14(18)12-7-6-11(20-12)13(15)17/h6-7,9-10H,2-5,8H2,1H3,(H2,15,17)(H,16,18)/t9-,10-/m0/s1.
What are the key properties of 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide?
2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide has a molecular weight of 280.32 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[(2S)-4-[(2R)-oxolan-2-yl]butan-2-yl]furan-2,5-dicarboxamide is sourced from PubChem (CID 97086861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).