N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide

C12H26N2O — CID 106140502

IUPACN-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide
SMILESCC(C)(CCCN)CNC(=O)C(C)(C)C
InChIInChI=1S/C12H26N2O/c1-11(2,3)10(15)14-9-12(4,5)7-6-8-13/h6-9,13H2,1-5H3,(H,14,15)
InChIKeyWOGUBKVFEFJZDO-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.91
Rot. Bonds5

About N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide

N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide (PubChem CID 106140502) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide
PubChem CID106140502
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide
SMILESCC(C)(CCCN)CNC(=O)C(C)(C)C
InChIInChI=1S/C12H26N2O/c1-11(2,3)10(15)14-9-12(4,5)7-6-8-13/h6-9,13H2,1-5H3,(H,14,15)
InChIKeyWOGUBKVFEFJZDO-UHFFFAOYSA-N
XLogP1.91
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide?
The IUPAC name of N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide (CID 106140502) is N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide.
What is the SMILES notation for N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide?
The canonical SMILES for N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide is CC(C)(CCCN)CNC(=O)C(C)(C)C.
What is the InChIKey of N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide?
The InChIKey is WOGUBKVFEFJZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-11(2,3)10(15)14-9-12(4,5)7-6-8-13/h6-9,13H2,1-5H3,(H,14,15).
What are the key properties of N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide?
N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide has a molecular weight of 214.35 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,2-dimethylpentyl)-2,2-dimethylpropanamide is sourced from PubChem (CID 106140502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).