N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide

C24H25FN2O2 — CID 165361570

IUPACN-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide
SMILESO=C(c1ccco1)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C24H25FN2O2/c25-20-8-4-9-22(18-20)27(24(28)23-10-5-17-29-23)21-12-15-26(16-13-21)14-11-19-6-2-1-3-7-19/h1-10,17-18,21H,11-16H2
InChIKeyNLTYWPGXHYUTRN-UHFFFAOYSA-N
MW392.47 g/mol
LogP4.77
Rot. Bonds6

About N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide

N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide (PubChem CID 165361570) has the molecular formula C24H25FN2O2 and a molecular weight of 392.47 g/mol. Its IUPAC name is N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide
PubChem CID165361570
Molecular FormulaC24H25FN2O2
Molecular Weight392.47 g/mol
Exact Mass392.19
IUPAC NameN-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide
SMILESO=C(c1ccco1)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C24H25FN2O2/c25-20-8-4-9-22(18-20)27(24(28)23-10-5-17-29-23)21-12-15-26(16-13-21)14-11-19-6-2-1-3-7-19/h1-10,17-18,21H,11-16H2
InChIKeyNLTYWPGXHYUTRN-UHFFFAOYSA-N
XLogP4.77
TPSA36.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.47
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide (CID 165361570) is N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide is O=C(c1ccco1)N(c1cccc(F)c1)C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide?
The InChIKey is NLTYWPGXHYUTRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FN2O2/c25-20-8-4-9-22(18-20)27(24(28)23-10-5-17-29-23)21-12-15-26(16-13-21)14-11-19-6-2-1-3-7-19/h1-10,17-18,21H,11-16H2.
What are the key properties of N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide?
N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide has a molecular weight of 392.47 g/mol, XLogP of 4.77, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-2-carboxamide is sourced from PubChem (CID 165361570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).