2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide

C14H30N2O — CID 119796586

IUPAC2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC(C)CCC(C)(C)C
InChIInChI=1S/C14H30N2O/c1-7-9-14(6,15)12(17)16-11(2)8-10-13(3,4)5/h11H,7-10,15H2,1-6H3,(H,16,17)
InChIKeySZSOYEBQPBDIFE-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.83
Rot. Bonds6

About 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide

2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide (PubChem CID 119796586) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide
PubChem CID119796586
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)NC(C)CCC(C)(C)C
InChIInChI=1S/C14H30N2O/c1-7-9-14(6,15)12(17)16-11(2)8-10-13(3,4)5/h11H,7-10,15H2,1-6H3,(H,16,17)
InChIKeySZSOYEBQPBDIFE-UHFFFAOYSA-N
XLogP2.83
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-methyl-N-(6-methylheptan-2-yl)pentanamide;hydrochloride
CID 119673366
2-amino-N-(1-cyanopropan-2-yl)-2-methylpentanamide
CID 62093373
2-[(2-amino-2-methylpentanoyl)amino]propanoic acid
CID 61157718
(2S)-2-[(2-amino-2-methylpentanoyl)amino]pentanoic acid
CID 103869776
2-amino-N-(1-amino-3-methyl-1-oxobutan-2-yl)-2-methylpentanamide
CID 106345053
methyl 2-[(2-amino-2-methylpentanoyl)amino]-3-methylpentanoate
CID 54928348
2-amino-N-[1-(4-chlorophenyl)propan-2-yl]-2-methylpentanamide
CID 54928444
2-amino-N-[1-(4-fluorophenyl)propan-2-yl]-2-methylpentanamide
CID 63008242
2-amino-N-(1-aminohexan-2-yl)-2-methylpentanamide
CID 122080967
2-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-methylpentanamide
CID 65049075
2-[(2-amino-2-methylpentanoyl)amino]-3-hydroxypropanoic acid
CID 61157022
(2S)-5-amino-2-[(2-amino-2-methylpentanoyl)amino]-5-oxopentanoic acid
CID 61159622

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide?
The IUPAC name of 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide (CID 119796586) is 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide?
The canonical SMILES for 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide is CCCC(C)(N)C(=O)NC(C)CCC(C)(C)C.
What is the InChIKey of 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide?
The InChIKey is SZSOYEBQPBDIFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-7-9-14(6,15)12(17)16-11(2)8-10-13(3,4)5/h11H,7-10,15H2,1-6H3,(H,16,17).
What are the key properties of 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide?
2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide has a molecular weight of 242.41 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5,5-dimethylhexan-2-yl)-2-methylpentanamide is sourced from PubChem (CID 119796586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).