N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide

C13H27NO — CID 170848513

IUPACN-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide
SMILESCCNC(=O)C(C)(CC(C)C)C(C)CC
InChIInChI=1S/C13H27NO/c1-7-11(5)13(6,9-10(3)4)12(15)14-8-2/h10-11H,7-9H2,1-6H3,(H,14,15)
InChIKeyKQNBRFYGCRCHFC-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.22
Rot. Bonds6

About N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide

N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide (PubChem CID 170848513) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide.

Molecular Properties

Compound NameN-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide
PubChem CID170848513
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC NameN-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide
SMILESCCNC(=O)C(C)(CC(C)C)C(C)CC
InChIInChI=1S/C13H27NO/c1-7-11(5)13(6,9-10(3)4)12(15)14-8-2/h10-11H,7-9H2,1-6H3,(H,14,15)
InChIKeyKQNBRFYGCRCHFC-UHFFFAOYSA-N
XLogP3.22
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;N-ethyl-2,2-dimethylpropanamide
CID 142466715
N-[2-(dimethylamino)ethyl]-2,4-dimethyl-2-propan-2-ylpentanamide
CID 166995281
methyl 2-ethyl-2,3-dimethylpentanoate
CID 23269301
2,2,4-trimethyl-N-propan-2-ylpentanamide
CID 126707660
N,2,2-triethyl-3-methylbutanamide
CID 3016601
N,2-diethyl-3-methyl-2-propan-2-ylbutanamide
CID 141274919
3,3-dimethylbutan-2-one;2-methylbutane
CID 91459434
4-amino-N-ethyl-2,3-dimethyl-2-phenylbutanamide;methanol
CID 143150724
2-amino-N-[1-(ethylamino)-1-oxobutan-2-yl]-4-methylpentanamide
CID 85264464
[3-(ethylamino)-2-methyl-2-(2-methylpropanoyloxymethyl)-3-oxopropyl] 2-methylpropanoate
CID 140728849
N-ethyl-2,2,2-trifluoroacetamide
CID 581108
3,3,5-trimethylhexan-2-one
CID 2776079

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide?
The IUPAC name of N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide (CID 170848513) is N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide.
What is the SMILES notation for N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide?
The canonical SMILES for N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide is CCNC(=O)C(C)(CC(C)C)C(C)CC.
What is the InChIKey of N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide?
The InChIKey is KQNBRFYGCRCHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-7-11(5)13(6,9-10(3)4)12(15)14-8-2/h10-11H,7-9H2,1-6H3,(H,14,15).
What are the key properties of N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide?
N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide has a molecular weight of 213.36 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,3-dimethyl-2-(2-methylpropyl)pentanamide is sourced from PubChem (CID 170848513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).