2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide

C14H29NO — CID 166894562

IUPAC2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide
SMILESCC(C)C(C)(C)C(C)(C)NC(=O)C(C)(C)C
InChIInChI=1S/C14H29NO/c1-10(2)13(6,7)14(8,9)15-11(16)12(3,4)5/h10H,1-9H3,(H,15,16)
InChIKeyZSABPPHVMCDAJE-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.61
Rot. Bonds3

About 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide

2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide (PubChem CID 166894562) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide
PubChem CID166894562
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide
SMILESCC(C)C(C)(C)C(C)(C)NC(=O)C(C)(C)C
InChIInChI=1S/C14H29NO/c1-10(2)13(6,7)14(8,9)15-11(16)12(3,4)5/h10H,1-9H3,(H,15,16)
InChIKeyZSABPPHVMCDAJE-UHFFFAOYSA-N
XLogP3.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide?
The IUPAC name of 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide (CID 166894562) is 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide?
The canonical SMILES for 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide is CC(C)C(C)(C)C(C)(C)NC(=O)C(C)(C)C.
What is the InChIKey of 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide?
The InChIKey is ZSABPPHVMCDAJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-10(2)13(6,7)14(8,9)15-11(16)12(3,4)5/h10H,1-9H3,(H,15,16).
What are the key properties of 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide?
2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide has a molecular weight of 227.39 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2,3,3,4-tetramethylpentan-2-yl)propanamide is sourced from PubChem (CID 166894562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).