N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide

C11H15ClN2O2 — CID 66183740

IUPACN-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide
SMILESCCCN(C(=O)c1ccc(Cl)o1)C1CNC1
InChIInChI=1S/C11H15ClN2O2/c1-2-5-14(8-6-13-7-8)11(15)9-3-4-10(12)16-9/h3-4,8,13H,2,5-7H2,1H3
InChIKeySCWFSYLIHVQVKT-UHFFFAOYSA-N
MW242.71 g/mol
LogP1.76
Rot. Bonds4

About N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide

N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide (PubChem CID 66183740) has the molecular formula C11H15ClN2O2 and a molecular weight of 242.71 g/mol. Its IUPAC name is N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide
PubChem CID66183740
Molecular FormulaC11H15ClN2O2
Molecular Weight242.71 g/mol
Exact Mass242.08
IUPAC NameN-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide
SMILESCCCN(C(=O)c1ccc(Cl)o1)C1CNC1
InChIInChI=1S/C11H15ClN2O2/c1-2-5-14(8-6-13-7-8)11(15)9-3-4-10(12)16-9/h3-4,8,13H,2,5-7H2,1H3
InChIKeySCWFSYLIHVQVKT-UHFFFAOYSA-N
XLogP1.76
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.71
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(azetidin-3-yl)-5-chloro-N-methylfuran-2-carboxamide
CID 66185904
N-(2-bromoethyl)-5-chloro-N-cyclopropylfuran-2-carboxamide
CID 106689937
N-(azetidin-3-yl)-7-bromo-N-propyl-1-benzofuran-2-carboxamide
CID 66213648
5-methyl-N-piperidin-4-yl-N-propylfuran-2-carboxamide
CID 60805408
N-(4-aminocyclohexyl)-5-chloro-N-ethylfuran-2-carboxamide
CID 79116022
N-(azetidin-3-yl)-4-oxo-N-propylchromene-2-carboxamide
CID 66181389
N-(2-amino-2-oxoethyl)-5-chloro-N-piperidin-4-ylfuran-2-carboxamide
CID 54923700
N-(azetidin-3-yl)-2,5-dimethyl-N-propylfuran-3-carboxamide
CID 66181383
N-(azetidin-3-yl)-5-bromo-N-propylthiophene-2-carboxamide
CID 66182885
N-(azetidin-3-yl)-5-chloro-2-iodo-N-propylbenzamide
CID 114030457
N-(azetidin-3-yl)-2-(3-chlorophenyl)-N-propylacetamide
CID 66182884
N-(2-chloroethyl)-N-cyclopentyl-5-ethylfuran-2-carboxamide
CID 79084217

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide?
The IUPAC name of N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide (CID 66183740) is N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide.
What is the SMILES notation for N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide?
The canonical SMILES for N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide is CCCN(C(=O)c1ccc(Cl)o1)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide?
The InChIKey is SCWFSYLIHVQVKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2O2/c1-2-5-14(8-6-13-7-8)11(15)9-3-4-10(12)16-9/h3-4,8,13H,2,5-7H2,1H3.
What are the key properties of N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide?
N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide has a molecular weight of 242.71 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-5-chloro-N-propylfuran-2-carboxamide is sourced from PubChem (CID 66183740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).