N-(2-ethyl-2-methylpentyl)-2-methylpropanamide

C12H25NO — CID 89177449

IUPACN-(2-ethyl-2-methylpentyl)-2-methylpropanamide
SMILESCCCC(C)(CC)CNC(=O)C(C)C
InChIInChI=1S/C12H25NO/c1-6-8-12(5,7-2)9-13-11(14)10(3)4/h10H,6-9H2,1-5H3,(H,13,14)
InChIKeyOERYPCMHDRJCLU-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.97
Rot. Bonds6

About N-(2-ethyl-2-methylpentyl)-2-methylpropanamide

N-(2-ethyl-2-methylpentyl)-2-methylpropanamide (PubChem CID 89177449) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is N-(2-ethyl-2-methylpentyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(2-ethyl-2-methylpentyl)-2-methylpropanamide
PubChem CID89177449
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC NameN-(2-ethyl-2-methylpentyl)-2-methylpropanamide
SMILESCCCC(C)(CC)CNC(=O)C(C)C
InChIInChI=1S/C12H25NO/c1-6-8-12(5,7-2)9-13-11(14)10(3)4/h10H,6-9H2,1-5H3,(H,13,14)
InChIKeyOERYPCMHDRJCLU-UHFFFAOYSA-N
XLogP2.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-hydroxy-2-propylpentyl)-2-methylpropanamide
CID 111444753
N-(2,4-diethyl-2,4-dimethylheptyl)-4-methylpentanamide
CID 155322176
N-(2,2-difluoropropyl)-2-methylpropanamide
CID 130436254
ethane;N-(2-hydroxy-2-methylpropyl)-2-methylpropanamide
CID 145182364
N-(2-hydroxy-2,4-dimethylpentyl)-2-methylpropanamide
CID 66180454
3-[(2-hydroxy-2-methylpentyl)amino]-2-methyl-3-oxopropanoic acid
CID 106295623
N-(2,3-dihydroxy-2-methylpropyl)-2-methylpropanamide
CID 66168288
N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide
CID 106292285
N-[2-(2,2-dimethylbutylamino)ethyl]-2-methylpropanamide
CID 146594177
(2R)-2-amino-N-(2-hydroxy-2-methylpentyl)-4-methylpentanamide
CID 106292244
2-methyl-N-(3-methyl-3-propan-2-yloctyl)propanamide
CID 126626622
N-tert-butyl-2-methylpropanamide;bis(N-ethyl-2-methylpropanamide)
CID 160609422

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-2-methylpentyl)-2-methylpropanamide?
The IUPAC name of N-(2-ethyl-2-methylpentyl)-2-methylpropanamide (CID 89177449) is N-(2-ethyl-2-methylpentyl)-2-methylpropanamide.
What is the SMILES notation for N-(2-ethyl-2-methylpentyl)-2-methylpropanamide?
The canonical SMILES for N-(2-ethyl-2-methylpentyl)-2-methylpropanamide is CCCC(C)(CC)CNC(=O)C(C)C.
What is the InChIKey of N-(2-ethyl-2-methylpentyl)-2-methylpropanamide?
The InChIKey is OERYPCMHDRJCLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-6-8-12(5,7-2)9-13-11(14)10(3)4/h10H,6-9H2,1-5H3,(H,13,14).
What are the key properties of N-(2-ethyl-2-methylpentyl)-2-methylpropanamide?
N-(2-ethyl-2-methylpentyl)-2-methylpropanamide has a molecular weight of 199.34 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-2-methylpentyl)-2-methylpropanamide is sourced from PubChem (CID 89177449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).