N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide

C23H29FN2O — CID 164851900

IUPACN-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
SMILESCCC(=O)N(Cc1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C23H29FN2O/c1-2-23(27)26(18-20-8-10-21(24)11-9-20)22-13-16-25(17-14-22)15-12-19-6-4-3-5-7-19/h3-11,22H,2,12-18H2,1H3
InChIKeyXXDSKBHNBRCBID-UHFFFAOYSA-N
MW368.50 g/mol
LogP4.27
Rot. Bonds7

About N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide

N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide (PubChem CID 164851900) has the molecular formula C23H29FN2O and a molecular weight of 368.50 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
PubChem CID164851900
Molecular FormulaC23H29FN2O
Molecular Weight368.50 g/mol
Exact Mass368.23
IUPAC NameN-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide
SMILESCCC(=O)N(Cc1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1
InChIInChI=1S/C23H29FN2O/c1-2-23(27)26(18-20-8-10-21(24)11-9-20)22-13-16-25(17-14-22)15-12-19-6-4-3-5-7-19/h3-11,22H,2,12-18H2,1H3
InChIKeyXXDSKBHNBRCBID-UHFFFAOYSA-N
XLogP4.27
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.50
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide (CID 164851900) is N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide is CCC(=O)N(Cc1ccc(F)cc1)C1CCN(CCc2ccccc2)CC1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
The InChIKey is XXDSKBHNBRCBID-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29FN2O/c1-2-23(27)26(18-20-8-10-21(24)11-9-20)22-13-16-25(17-14-22)15-12-19-6-4-3-5-7-19/h3-11,22H,2,12-18H2,1H3.
What are the key properties of N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide?
N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide has a molecular weight of 368.50 g/mol, XLogP of 4.27, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-N-[1-(2-phenylethyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 164851900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).