(3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide

C14H20N2O — CID 178194057

IUPAC(3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide
SMILESCN(C)C(=O)[C@H]1CNC[C@@H](c2ccccc2)C1
InChIInChI=1S/C14H20N2O/c1-16(2)14(17)13-8-12(9-15-10-13)11-6-4-3-5-7-11/h3-7,12-13,15H,8-10H2,1-2H3/t12-,13+/m0/s1
InChIKeyMKISMHZLEIVXFR-QWHCGFSZSA-N
MW232.33 g/mol
LogP1.47
Rot. Bonds2

About (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide

(3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide (PubChem CID 178194057) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide
PubChem CID178194057
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name(3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide
SMILESCN(C)C(=O)[C@H]1CNC[C@@H](c2ccccc2)C1
InChIInChI=1S/C14H20N2O/c1-16(2)14(17)13-8-12(9-15-10-13)11-6-4-3-5-7-11/h3-7,12-13,15H,8-10H2,1-2H3/t12-,13+/m0/s1
InChIKeyMKISMHZLEIVXFR-QWHCGFSZSA-N
XLogP1.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide?
The IUPAC name of (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide (CID 178194057) is (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide.
What is the SMILES notation for (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide?
The canonical SMILES for (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide is CN(C)C(=O)[C@H]1CNC[C@@H](c2ccccc2)C1.
What is the InChIKey of (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide?
The InChIKey is MKISMHZLEIVXFR-QWHCGFSZSA-N. The full InChI is InChI=1S/C14H20N2O/c1-16(2)14(17)13-8-12(9-15-10-13)11-6-4-3-5-7-11/h3-7,12-13,15H,8-10H2,1-2H3/t12-,13+/m0/s1.
What are the key properties of (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide?
(3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide has a molecular weight of 232.33 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5R)-N,N-dimethyl-5-phenylpiperidine-3-carboxamide is sourced from PubChem (CID 178194057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).