N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide

C17H26N2O — CID 112985421

IUPACN-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide
SMILESCCC1CCCCN1c1ccc(NC(=O)C(C)C)cc1
InChIInChI=1S/C17H26N2O/c1-4-15-7-5-6-12-19(15)16-10-8-14(9-11-16)18-17(20)13(2)3/h8-11,13,15H,4-7,12H2,1-3H3,(H,18,20)
InChIKeyWJXMVMFMJIKXDD-UHFFFAOYSA-N
MW274.41 g/mol
LogP4.05
Rot. Bonds4

About N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide

N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide (PubChem CID 112985421) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide
PubChem CID112985421
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide
SMILESCCC1CCCCN1c1ccc(NC(=O)C(C)C)cc1
InChIInChI=1S/C17H26N2O/c1-4-15-7-5-6-12-19(15)16-10-8-14(9-11-16)18-17(20)13(2)3/h8-11,13,15H,4-7,12H2,1-3H3,(H,18,20)
InChIKeyWJXMVMFMJIKXDD-UHFFFAOYSA-N
XLogP4.05
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 ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-(2-ethylpiperidin-1-yl)phenyl]cyclopropanecarboxamide
CID 112985422
N-[4-(2-ethylpiperidin-1-yl)phenyl]thiophene-2-carboxamide
CID 112985429
N-[4-(2-ethylpiperidin-1-yl)phenyl]-1,3-benzodioxole-5-carboxamide
CID 112985450
N-(4-chlorophenyl)-5-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196262
N-[4-(2-ethylpiperidin-1-yl)phenyl]-3-methoxybenzamide
CID 112985435
2-ethyl-1-(4-methylphenyl)piperidine
CID 90712958
N-[4-[2-(aminomethyl)piperidine-1-carbonyl]phenyl]-2-methylpropanamide
CID 119468615
N-[4-(2-ethylpiperidin-1-yl)phenyl]-4-(1-methylpyrrole-2-carbonyl)piperazine-1-carboxamide
CID 66584478
N-(4-ethoxyphenyl)-5-(2-ethylpiperidin-1-yl)pyridine-2-carboxamide
CID 109196271
1-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-3-phenylurea
CID 113030715
2-methyl-N-[4-[(2-methylpiperidin-1-yl)methyl]phenyl]propanamide
CID 47288928
N-[4-(4-cyclohexylpiperazin-1-yl)phenyl]-2-methylpropanamide
CID 112502772

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide?
The IUPAC name of N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide (CID 112985421) is N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide.
What is the SMILES notation for N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide?
The canonical SMILES for N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide is CCC1CCCCN1c1ccc(NC(=O)C(C)C)cc1.
What is the InChIKey of N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide?
The InChIKey is WJXMVMFMJIKXDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-15-7-5-6-12-19(15)16-10-8-14(9-11-16)18-17(20)13(2)3/h8-11,13,15H,4-7,12H2,1-3H3,(H,18,20).
What are the key properties of N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide?
N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide has a molecular weight of 274.41 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide is sourced from PubChem (CID 112985421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).