N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide

C8H9ClN2O2 — CID 106688544

IUPACN-(azetidin-3-yl)-2-chlorofuran-3-carboxamide
SMILESO=C(NC1CNC1)c1ccoc1Cl
InChIInChI=1S/C8H9ClN2O2/c9-7-6(1-2-13-7)8(12)11-5-3-10-4-5/h1-2,5,10H,3-4H2,(H,11,12)
InChIKeyAPZAIJPWQHYYNB-UHFFFAOYSA-N
MW200.62 g/mol
LogP0.63
Rot. Bonds2

About N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide

N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide (PubChem CID 106688544) has the molecular formula C8H9ClN2O2 and a molecular weight of 200.62 g/mol. Its IUPAC name is N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-2-chlorofuran-3-carboxamide
PubChem CID106688544
Molecular FormulaC8H9ClN2O2
Molecular Weight200.62 g/mol
Exact Mass200.04
IUPAC NameN-(azetidin-3-yl)-2-chlorofuran-3-carboxamide
SMILESO=C(NC1CNC1)c1ccoc1Cl
InChIInChI=1S/C8H9ClN2O2/c9-7-6(1-2-13-7)8(12)11-5-3-10-4-5/h1-2,5,10H,3-4H2,(H,11,12)
InChIKeyAPZAIJPWQHYYNB-UHFFFAOYSA-N
XLogP0.63
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.62
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-(4-methylcyclohexyl)furan-3-carboxamide
CID 106685258
2-chloro-N-(oxan-3-yl)furan-3-carboxamide
CID 130173637
2-chloro-N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]furan-3-carboxamide
CID 106686097
N-(5-azaspiro[3.5]nonan-8-yl)-2-chlorofuran-3-carboxamide
CID 106688425
2,3,3a,4,6,6a-hexahydro-1H-pyrrolo[3,4-c]pyrrol-5-yl-(2-chlorofuran-3-yl)methanone
CID 106688551
2-chloro-N-(2-hydroxycycloheptyl)furan-3-carboxamide
CID 106687172
2-chloro-N-[2-(cyclopropanecarbonylamino)ethyl]furan-3-carboxamide
CID 106687261
2-chloro-N-(2-methylcyclohexyl)furan-3-carboxamide
CID 106685279
2-chloro-N-(2,6-dioxopiperidin-3-yl)furan-3-carboxamide
CID 106686964
2-chloro-N-propylfuran-3-carboxamide
CID 106685121
ethyl 4-[(2-chlorofuran-3-carbonyl)amino]cyclohexane-1-carboxylate
CID 106685563
2-chloro-N-(3-ethylsulfanylcyclopentyl)furan-3-carboxamide
CID 106812168

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide?
The IUPAC name of N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide (CID 106688544) is N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide.
What is the SMILES notation for N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide?
The canonical SMILES for N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide is O=C(NC1CNC1)c1ccoc1Cl.
What is the InChIKey of N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide?
The InChIKey is APZAIJPWQHYYNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O2/c9-7-6(1-2-13-7)8(12)11-5-3-10-4-5/h1-2,5,10H,3-4H2,(H,11,12).
What are the key properties of N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide?
N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide has a molecular weight of 200.62 g/mol, XLogP of 0.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-2-chlorofuran-3-carboxamide is sourced from PubChem (CID 106688544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).