N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide

C16H14ClNO5 — CID 151041504

IUPACN-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide
SMILESCOc1ccc(Cl)cc1N(C(=O)c1ccco1)C1CCOC1=O
InChIInChI=1S/C16H14ClNO5/c1-21-13-5-4-10(17)9-12(13)18(11-6-8-23-16(11)20)15(19)14-3-2-7-22-14/h2-5,7,9,11H,6,8H2,1H3
InChIKeyMCEJWRIFTKAINZ-UHFFFAOYSA-N
MW335.74 g/mol
LogP2.90
Rot. Bonds4

About N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide

N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide (PubChem CID 151041504) has the molecular formula C16H14ClNO5 and a molecular weight of 335.74 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide
PubChem CID151041504
Molecular FormulaC16H14ClNO5
Molecular Weight335.74 g/mol
Exact Mass335.06
IUPAC NameN-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide
SMILESCOc1ccc(Cl)cc1N(C(=O)c1ccco1)C1CCOC1=O
InChIInChI=1S/C16H14ClNO5/c1-21-13-5-4-10(17)9-12(13)18(11-6-8-23-16(11)20)15(19)14-3-2-7-22-14/h2-5,7,9,11H,6,8H2,1H3
InChIKeyMCEJWRIFTKAINZ-UHFFFAOYSA-N
XLogP2.90
TPSA68.98 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.74
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-[(5-chloro-2-methoxyphenyl)methyl-methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 33164416
N-(5-chloro-2-methoxyphenyl)-N-methylcarbamoyl chloride
CID 115194462
N-(5-chloro-2-methoxyphenyl)-N-methyl-1-oxoisochromene-4-carboxamide
CID 4179677
methyl (4S)-4-[4-(furan-2-carbonyloxy)-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
CID 1161280
[4-(5-chloro-2-methoxybenzoyl)-1,4-diazepan-1-yl]-(furan-2-yl)methanone
CID 110807734
2-(3,4-dimethoxyphenyl)-3-(furan-2-carbonyl)-4-hydroxy-1,2-dihydropyrrol-5-one
CID 3155876
N-(3,4-dimethoxyphenyl)-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]furan-2-carboxamide
CID 42853300
N-[(2S)-1-[2-(5-chloro-2-methoxybenzoyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide
CID 9278474
N-(3-chloro-4-fluorophenyl)-N-[2-(cyclopentylamino)-2-oxo-1-(3,4,5-trimethoxyphenyl)ethyl]furan-2-carboxamide
CID 3196797
N-[(7S,8aS)-2-(5-chloro-2-methoxyphenyl)-1,3-dioxo-6,7,8,8a-tetrahydro-5H-imidazo[1,5-a]pyridin-7-yl]furan-2-carboxamide
CID 7051204
(2,4-dichlorophenyl) furan-2-carboxylate
CID 3880755
[2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl] 5-chloro-2-methoxybenzoate
CID 7582114

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide (CID 151041504) is N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide is COc1ccc(Cl)cc1N(C(=O)c1ccco1)C1CCOC1=O.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide?
The InChIKey is MCEJWRIFTKAINZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClNO5/c1-21-13-5-4-10(17)9-12(13)18(11-6-8-23-16(11)20)15(19)14-3-2-7-22-14/h2-5,7,9,11H,6,8H2,1H3.
What are the key properties of N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide?
N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide has a molecular weight of 335.74 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-N-(2-oxooxolan-3-yl)furan-2-carboxamide is sourced from PubChem (CID 151041504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).