N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide

C16H16FNO3 — CID 71993760

IUPACN-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide
SMILESO=C(NC1(c2cccc(F)c2)CCOCC1)c1ccoc1
InChIInChI=1S/C16H16FNO3/c17-14-3-1-2-13(10-14)16(5-8-20-9-6-16)18-15(19)12-4-7-21-11-12/h1-4,7,10-11H,5-6,8-9H2,(H,18,19)
InChIKeyKFNAFNRIGOSJFH-UHFFFAOYSA-N
MW289.31 g/mol
LogP2.85
Rot. Bonds3

About N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide

N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide (PubChem CID 71993760) has the molecular formula C16H16FNO3 and a molecular weight of 289.31 g/mol. Its IUPAC name is N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide
PubChem CID71993760
Molecular FormulaC16H16FNO3
Molecular Weight289.31 g/mol
Exact Mass289.11
IUPAC NameN-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide
SMILESO=C(NC1(c2cccc(F)c2)CCOCC1)c1ccoc1
InChIInChI=1S/C16H16FNO3/c17-14-3-1-2-13(10-14)16(5-8-20-9-6-16)18-15(19)12-4-7-21-11-12/h1-4,7,10-11H,5-6,8-9H2,(H,18,19)
InChIKeyKFNAFNRIGOSJFH-UHFFFAOYSA-N
XLogP2.85
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-phenyloxan-4-yl)furan-3-carboxamide
CID 110466381
4-(aminomethyl)-N-[4-(3-fluorophenyl)oxan-4-yl]benzamide
CID 119342225
N-(4-pyrimidin-2-yloxan-4-yl)furan-3-carboxamide
CID 138024801
2-[3-[[4-(3-fluorophenyl)oxan-4-yl]carbamoyl]phenoxy]acetic acid
CID 119187111
2-[[4-(3-fluorophenyl)oxan-4-yl]carbamoyl]cyclobutane-1-carboxylic acid
CID 120976524
N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-3,4-dihydro-2H-pyran-5-carboxamide
CID 99819235
N-[4-(3-fluorophenyl)oxan-4-yl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 71993748
N-[4-(3-fluorophenyl)oxan-4-yl]formamide
CID 175327323
7-amino-N-[4-(3-fluorophenyl)oxan-4-yl]heptanamide;hydrochloride
CID 119816174
N-[4-(3-fluorophenyl)oxan-4-yl]-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 139005167
N-[4-(3-fluorophenyl)oxan-4-yl]-5-methyl-1-piperidin-4-yltriazole-4-carboxamide;hydrochloride
CID 119816176
N-[4-(3-fluorophenyl)oxan-4-yl]-5-methyl-1,2-benzothiazole-3-carboxamide
CID 128517966

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide?
The IUPAC name of N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide (CID 71993760) is N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide.
What is the SMILES notation for N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide?
The canonical SMILES for N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide is O=C(NC1(c2cccc(F)c2)CCOCC1)c1ccoc1.
What is the InChIKey of N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide?
The InChIKey is KFNAFNRIGOSJFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO3/c17-14-3-1-2-13(10-14)16(5-8-20-9-6-16)18-15(19)12-4-7-21-11-12/h1-4,7,10-11H,5-6,8-9H2,(H,18,19).
What are the key properties of N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide?
N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide has a molecular weight of 289.31 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-fluorophenyl)oxan-4-yl]furan-3-carboxamide is sourced from PubChem (CID 71993760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).