2-chloro-N-(oxan-3-yl)furan-3-carboxamide

C10H12ClNO3 — CID 130173637

IUPAC2-chloro-N-(oxan-3-yl)furan-3-carboxamide
SMILESO=C(NC1CCCOC1)c1ccoc1Cl
InChIInChI=1S/C10H12ClNO3/c11-9-8(3-5-15-9)10(13)12-7-2-1-4-14-6-7/h3,5,7H,1-2,4,6H2,(H,12,13)
InChIKeyPTMSAUHKPGQCMO-UHFFFAOYSA-N
MW229.66 g/mol
LogP1.84
Rot. Bonds2

About 2-chloro-N-(oxan-3-yl)furan-3-carboxamide

2-chloro-N-(oxan-3-yl)furan-3-carboxamide (PubChem CID 130173637) has the molecular formula C10H12ClNO3 and a molecular weight of 229.66 g/mol. Its IUPAC name is 2-chloro-N-(oxan-3-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(oxan-3-yl)furan-3-carboxamide
PubChem CID130173637
Molecular FormulaC10H12ClNO3
Molecular Weight229.66 g/mol
Exact Mass229.05
IUPAC Name2-chloro-N-(oxan-3-yl)furan-3-carboxamide
SMILESO=C(NC1CCCOC1)c1ccoc1Cl
InChIInChI=1S/C10H12ClNO3/c11-9-8(3-5-15-9)10(13)12-7-2-1-4-14-6-7/h3,5,7H,1-2,4,6H2,(H,12,13)
InChIKeyPTMSAUHKPGQCMO-UHFFFAOYSA-N
XLogP1.84
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.66
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide
CID 106685258
N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide
CID 106688544
2-chloro-N-(oxan-3-yl)-4-(1,2,4-triazol-4-yl)benzamide
CID 46963454
2-chloro-N-(2-hydroxycycloheptyl)furan-3-carboxamide
CID 106687172
2,4-dihydroxy-N-(oxan-3-yl)benzamide
CID 113232786
2-chloro-N-(2-methylcyclohexyl)furan-3-carboxamide
CID 106685279
2-amino-N-cyclopentylfuran-3-carboxamide
CID 117213301
3-hydroxy-2-methyl-N-(oxan-3-yl)benzamide
CID 82829580
3-chloro-2-nitro-N-(oxan-3-yl)benzamide
CID 79831055
2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide
CID 106687114
5-amino-N-(oxan-3-yl)-1H-pyrazole-4-carboxamide
CID 63361518
3-hydrazinyl-N-(oxan-3-yl)pyridine-4-carboxamide
CID 105072165

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(oxan-3-yl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(oxan-3-yl)furan-3-carboxamide (CID 130173637) is 2-chloro-N-(oxan-3-yl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(oxan-3-yl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(oxan-3-yl)furan-3-carboxamide is O=C(NC1CCCOC1)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-(oxan-3-yl)furan-3-carboxamide?
The InChIKey is PTMSAUHKPGQCMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO3/c11-9-8(3-5-15-9)10(13)12-7-2-1-4-14-6-7/h3,5,7H,1-2,4,6H2,(H,12,13).
What are the key properties of 2-chloro-N-(oxan-3-yl)furan-3-carboxamide?
2-chloro-N-(oxan-3-yl)furan-3-carboxamide has a molecular weight of 229.66 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(oxan-3-yl)furan-3-carboxamide is sourced from PubChem (CID 130173637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).