(2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide

C17H26N2O — CID 51944426

IUPAC(2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide
SMILESCC[C@@H]1CCCCN1C(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C17H26N2O/c1-4-14-9-7-8-12-19(14)17(20)18-16-11-6-5-10-15(16)13(2)3/h5-6,10-11,13-14H,4,7-9,12H2,1-3H3,(H,18,20)/t14-/m1/s1
InChIKeyZAGTUQKDGICCRE-CQSZACIVSA-N
MW274.41 g/mol
LogP4.61
Rot. Bonds3

About (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide

(2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide (PubChem CID 51944426) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide
PubChem CID51944426
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name(2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide
SMILESCC[C@@H]1CCCCN1C(=O)Nc1ccccc1C(C)C
InChIInChI=1S/C17H26N2O/c1-4-14-9-7-8-12-19(14)17(20)18-16-11-6-5-10-15(16)13(2)3/h5-6,10-11,13-14H,4,7-9,12H2,1-3H3,(H,18,20)/t14-/m1/s1
InChIKeyZAGTUQKDGICCRE-CQSZACIVSA-N
XLogP4.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide?
The IUPAC name of (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide (CID 51944426) is (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide?
The canonical SMILES for (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide is CC[C@@H]1CCCCN1C(=O)Nc1ccccc1C(C)C.
What is the InChIKey of (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide?
The InChIKey is ZAGTUQKDGICCRE-CQSZACIVSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-14-9-7-8-12-19(14)17(20)18-16-11-6-5-10-15(16)13(2)3/h5-6,10-11,13-14H,4,7-9,12H2,1-3H3,(H,18,20)/t14-/m1/s1.
What are the key properties of (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide?
(2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 4.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-ethyl-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 51944426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).