2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide

C17H26N2O — CID 107147526

IUPAC2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide
SMILESCC(C)c1cccc(NC(=O)CC2NCCCC2C)c1
InChIInChI=1S/C17H26N2O/c1-12(2)14-7-4-8-15(10-14)19-17(20)11-16-13(3)6-5-9-18-16/h4,7-8,10,12-13,16,18H,5-6,9,11H2,1-3H3,(H,19,20)
InChIKeyBBXMWXNKVONWER-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.53
Rot. Bonds4

About 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide

2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide (PubChem CID 107147526) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide
PubChem CID107147526
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide
SMILESCC(C)c1cccc(NC(=O)CC2NCCCC2C)c1
InChIInChI=1S/C17H26N2O/c1-12(2)14-7-4-8-15(10-14)19-17(20)11-16-13(3)6-5-9-18-16/h4,7-8,10,12-13,16,18H,5-6,9,11H2,1-3H3,(H,19,20)
InChIKeyBBXMWXNKVONWER-UHFFFAOYSA-N
XLogP3.53
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-propan-2-ylphenyl)-2-pyrrolidin-2-ylacetamide
CID 61372360
N-(3-ethoxyphenyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147673
2-cyclohexylsulfanyl-N-(3-propan-2-ylphenyl)acetamide
CID 134042023
2-[(3R)-3-methylpiperazin-1-yl]-N-(3-propan-2-ylphenyl)acetamide
CID 104975859
2-methyl-N-[3-[(2-pyrrolidin-2-ylacetyl)amino]phenyl]propanamide
CID 61366011
2-methyl-N-(3-propan-2-ylphenyl)piperidine-4-carboxamide
CID 106738709
N-(2-methoxyphenyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147403
2-[2-(aminomethyl)-3-methylpiperidin-1-yl]-N-(3-propan-2-ylphenyl)acetamide
CID 119925950
2-[methyl(piperidin-4-yl)amino]-N-(3-propan-2-ylphenyl)acetamide;hydrochloride
CID 119912537
3-methyl-N-(3-propan-2-ylphenyl)butanamide
CID 21491914
3-oxo-3-(3-propan-2-ylanilino)propanoic acid
CID 62230571
2-(2-formylpiperidin-1-yl)-N-(3-propan-2-ylphenyl)acetamide
CID 62654256

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide (CID 107147526) is 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide is CC(C)c1cccc(NC(=O)CC2NCCCC2C)c1.
What is the InChIKey of 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide?
The InChIKey is BBXMWXNKVONWER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12(2)14-7-4-8-15(10-14)19-17(20)11-16-13(3)6-5-9-18-16/h4,7-8,10,12-13,16,18H,5-6,9,11H2,1-3H3,(H,19,20).
What are the key properties of 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide?
2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide has a molecular weight of 274.41 g/mol, XLogP of 3.53, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylpiperidin-2-yl)-N-(3-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 107147526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).