N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide

C15H21FN2O3 — CID 124588204

IUPACN-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide
SMILESCOC1(C(=O)NC[C@H](O)c2ccc(F)cc2)CCNCC1
InChIInChI=1S/C15H21FN2O3/c1-21-15(6-8-17-9-7-15)14(20)18-10-13(19)11-2-4-12(16)5-3-11/h2-5,13,17,19H,6-10H2,1H3,(H,18,20)/t13-/m0/s1
InChIKeyPHVUHGXNYPWODH-ZDUSSCGKSA-N
MW296.34 g/mol
LogP0.74
Rot. Bonds5

About N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide

N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide (PubChem CID 124588204) has the molecular formula C15H21FN2O3 and a molecular weight of 296.34 g/mol. Its IUPAC name is N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide
PubChem CID124588204
Molecular FormulaC15H21FN2O3
Molecular Weight296.34 g/mol
Exact Mass296.15
IUPAC NameN-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide
SMILESCOC1(C(=O)NC[C@H](O)c2ccc(F)cc2)CCNCC1
InChIInChI=1S/C15H21FN2O3/c1-21-15(6-8-17-9-7-15)14(20)18-10-13(19)11-2-4-12(16)5-3-11/h2-5,13,17,19H,6-10H2,1H3,(H,18,20)/t13-/m0/s1
InChIKeyPHVUHGXNYPWODH-ZDUSSCGKSA-N
XLogP0.74
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.34
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-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 N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide?
The IUPAC name of N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide (CID 124588204) is N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide.
What is the SMILES notation for N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide?
The canonical SMILES for N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide is COC1(C(=O)NC[C@H](O)c2ccc(F)cc2)CCNCC1.
What is the InChIKey of N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide?
The InChIKey is PHVUHGXNYPWODH-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H21FN2O3/c1-21-15(6-8-17-9-7-15)14(20)18-10-13(19)11-2-4-12(16)5-3-11/h2-5,13,17,19H,6-10H2,1H3,(H,18,20)/t13-/m0/s1.
What are the key properties of N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide?
N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide has a molecular weight of 296.34 g/mol, XLogP of 0.74, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(4-fluorophenyl)-2-hydroxyethyl]-4-methoxypiperidine-4-carboxamide is sourced from PubChem (CID 124588204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).