2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide

C17H28N2O — CID 3054960

IUPAC2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide
SMILESCC(C)(C)CC(CC(C)(C)C)(C(N)=O)c1ccccn1
InChIInChI=1S/C17H28N2O/c1-15(2,3)11-17(14(18)20,12-16(4,5)6)13-9-7-8-10-19-13/h7-10H,11-12H2,1-6H3,(H2,18,20)
InChIKeyKXJVFHDJRWHGPE-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.68
Rot. Bonds4

About 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide

2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide (PubChem CID 3054960) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide.

Molecular Properties

Compound Name2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide
PubChem CID3054960
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide
SMILESCC(C)(C)CC(CC(C)(C)C)(C(N)=O)c1ccccn1
InChIInChI=1S/C17H28N2O/c1-15(2,3)11-17(14(18)20,12-16(4,5)6)13-9-7-8-10-19-13/h7-10H,11-12H2,1-6H3,(H2,18,20)
InChIKeyKXJVFHDJRWHGPE-UHFFFAOYSA-N
XLogP3.68
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide?
The IUPAC name of 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide (CID 3054960) is 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide.
What is the SMILES notation for 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide?
The canonical SMILES for 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide is CC(C)(C)CC(CC(C)(C)C)(C(N)=O)c1ccccn1.
What is the InChIKey of 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide?
The InChIKey is KXJVFHDJRWHGPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-15(2,3)11-17(14(18)20,12-16(4,5)6)13-9-7-8-10-19-13/h7-10H,11-12H2,1-6H3,(H2,18,20).
What are the key properties of 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide?
2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide has a molecular weight of 276.42 g/mol, XLogP of 3.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylpropyl)-4,4-dimethyl-2-pyridin-2-ylpentanamide is sourced from PubChem (CID 3054960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).