N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide

C19H22FNO2 — CID 4263998

IUPACN-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide
SMILESO=C(CC(c1ccc(F)cc1)c1ccco1)NC1CCCCC1
InChIInChI=1S/C19H22FNO2/c20-15-10-8-14(9-11-15)17(18-7-4-12-23-18)13-19(22)21-16-5-2-1-3-6-16/h4,7-12,16-17H,1-3,5-6,13H2,(H,21,22)
InChIKeyMIYQYMXBYUYIOE-UHFFFAOYSA-N
MW315.39 g/mol
LogP4.39
Rot. Bonds5

About N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide

N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide (PubChem CID 4263998) has the molecular formula C19H22FNO2 and a molecular weight of 315.39 g/mol. Its IUPAC name is N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide
PubChem CID4263998
Molecular FormulaC19H22FNO2
Molecular Weight315.39 g/mol
Exact Mass315.16
IUPAC NameN-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide
SMILESO=C(CC(c1ccc(F)cc1)c1ccco1)NC1CCCCC1
InChIInChI=1S/C19H22FNO2/c20-15-10-8-14(9-11-15)17(18-7-4-12-23-18)13-19(22)21-16-5-2-1-3-6-16/h4,7-12,16-17H,1-3,5-6,13H2,(H,21,22)
InChIKeyMIYQYMXBYUYIOE-UHFFFAOYSA-N
XLogP4.39
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.39
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide?
The IUPAC name of N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide (CID 4263998) is N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide.
What is the SMILES notation for N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide?
The canonical SMILES for N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide is O=C(CC(c1ccc(F)cc1)c1ccco1)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide?
The InChIKey is MIYQYMXBYUYIOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FNO2/c20-15-10-8-14(9-11-15)17(18-7-4-12-23-18)13-19(22)21-16-5-2-1-3-6-16/h4,7-12,16-17H,1-3,5-6,13H2,(H,21,22).
What are the key properties of N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide?
N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide has a molecular weight of 315.39 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(4-fluorophenyl)-3-(furan-2-yl)propanamide is sourced from PubChem (CID 4263998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).