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

C10H12ClNO3 — CID 106687114

IUPAC2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide
SMILESCC1OCCC1NC(=O)c1ccoc1Cl
InChIInChI=1S/C10H12ClNO3/c1-6-8(3-5-14-6)12-10(13)7-2-4-15-9(7)11/h2,4,6,8H,3,5H2,1H3,(H,12,13)
InChIKeyZNFBXFDSSDTHTQ-UHFFFAOYSA-N
MW229.66 g/mol
LogP1.84
Rot. Bonds2

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

2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide (PubChem CID 106687114) has the molecular formula C10H12ClNO3 and a molecular weight of 229.66 g/mol. Its IUPAC name is 2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide.

Molecular Properties

Compound Name2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide
PubChem CID106687114
Molecular FormulaC10H12ClNO3
Molecular Weight229.66 g/mol
Exact Mass229.05
IUPAC Name2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide
SMILESCC1OCCC1NC(=O)c1ccoc1Cl
InChIInChI=1S/C10H12ClNO3/c1-6-8(3-5-14-6)12-10(13)7-2-4-15-9(7)11/h2,4,6,8H,3,5H2,1H3,(H,12,13)
InChIKeyZNFBXFDSSDTHTQ-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

N-[(3S*,4S*)-1-isopropyl-4-methoxypyrrolidin-3-yl]-3-furamide
CID 91792411
2-chloro-N-[(1S)-3-hydroxy-1-(oxan-4-yl)propyl]furan-3-carboxamide
CID 164634754
2-chloro-N-[(2S)-1-cyanobutan-2-yl]furan-3-carboxamide
CID 164643454
2-chloro-N-(2,2,2-trifluoroethyl)furan-3-carboxamide
CID 106685254
2-chloro-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]furan-3-carboxamide
CID 106685850
2-chloro-N-[3-(trifluoromethyl)cyclohexyl]furan-3-carboxamide
CID 106686095
2-chloro-N-[4-(trifluoromethyl)cyclohexyl]furan-3-carboxamide
CID 106686115
2-chloro-N-[2-(trifluoromethyl)cyclohexyl]furan-3-carboxamide
CID 106686116
2-chloro-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]furan-3-carboxamide
CID 106686153
2-chloro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)furan-3-carboxamide
CID 106686317
2-chloro-N-methyl-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]furan-3-carboxamide
CID 106686322
2-chloro-N-(3,3,3-trifluoropropyl)furan-3-carboxamide
CID 106686799

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide?
The IUPAC name of 2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide (CID 106687114) is 2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide.
What is the SMILES notation for 2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide?
The canonical SMILES for 2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide is CC1OCCC1NC(=O)c1ccoc1Cl.
What is the InChIKey of 2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide?
The InChIKey is ZNFBXFDSSDTHTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO3/c1-6-8(3-5-14-6)12-10(13)7-2-4-15-9(7)11/h2,4,6,8H,3,5H2,1H3,(H,12,13).
What are the key properties of 2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide?
2-chloro-N-(2-methyloxolan-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-(2-methyloxolan-3-yl)furan-3-carboxamide is sourced from PubChem (CID 106687114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).