2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide

C17H26N2O — CID 2655206

IUPAC2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CN1CCCC[C@H]1C
InChIInChI=1S/C17H26N2O/c1-13(2)15-9-4-5-10-16(15)18-17(20)12-19-11-7-6-8-14(19)3/h4-5,9-10,13-14H,6-8,11-12H2,1-3H3,(H,18,20)/t14-/m1/s1
InChIKeyMHBUVPSAAXMVNA-CQSZACIVSA-N
MW274.41 g/mol
LogP3.62
Rot. Bonds4

About 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide

2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 2655206) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide
PubChem CID2655206
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CN1CCCC[C@H]1C
InChIInChI=1S/C17H26N2O/c1-13(2)15-9-4-5-10-16(15)18-17(20)12-19-11-7-6-8-14(19)3/h4-5,9-10,13-14H,6-8,11-12H2,1-3H3,(H,18,20)/t14-/m1/s1
InChIKeyMHBUVPSAAXMVNA-CQSZACIVSA-N
XLogP3.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide (CID 2655206) is 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide is CC(C)c1ccccc1NC(=O)CN1CCCC[C@H]1C.
What is the InChIKey of 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is MHBUVPSAAXMVNA-CQSZACIVSA-N. The full InChI is InChI=1S/C17H26N2O/c1-13(2)15-9-4-5-10-16(15)18-17(20)12-19-11-7-6-8-14(19)3/h4-5,9-10,13-14H,6-8,11-12H2,1-3H3,(H,18,20)/t14-/m1/s1.
What are the key properties of 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide?
2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 274.41 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-methylpiperidin-1-yl]-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 2655206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).