1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide

C15H21FN2O2 — CID 63372661

IUPAC1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1c1ccc(F)cc1[C@@H](C)O
InChIInChI=1S/C15H21FN2O2/c1-9-3-4-11(15(17)20)8-18(9)14-6-5-12(16)7-13(14)10(2)19/h5-7,9-11,19H,3-4,8H2,1-2H3,(H2,17,20)/t9?,10-,11?/m1/s1
InChIKeyCDTZXEXNVIQBNM-HSOILSAZSA-N
MW280.34 g/mol
LogP1.97
Rot. Bonds3

About 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide

1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide (PubChem CID 63372661) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide
PubChem CID63372661
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1c1ccc(F)cc1[C@@H](C)O
InChIInChI=1S/C15H21FN2O2/c1-9-3-4-11(15(17)20)8-18(9)14-6-5-12(16)7-13(14)10(2)19/h5-7,9-11,19H,3-4,8H2,1-2H3,(H2,17,20)/t9?,10-,11?/m1/s1
InChIKeyCDTZXEXNVIQBNM-HSOILSAZSA-N
XLogP1.97
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide (CID 63372661) is 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1c1ccc(F)cc1[C@@H](C)O.
What is the InChIKey of 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide?
The InChIKey is CDTZXEXNVIQBNM-HSOILSAZSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-9-3-4-11(15(17)20)8-18(9)14-6-5-12(16)7-13(14)10(2)19/h5-7,9-11,19H,3-4,8H2,1-2H3,(H2,17,20)/t9?,10-,11?/m1/s1.
What are the key properties of 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide?
1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide has a molecular weight of 280.34 g/mol, XLogP of 1.97, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-fluoro-2-[(1R)-1-hydroxyethyl]phenyl]-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 63372661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).