2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide

C13H28N2O — CID 103461265

IUPAC2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CNCC(C)(C)CC
InChIInChI=1S/C13H28N2O/c1-6-8-11(3)15-12(16)9-14-10-13(4,5)7-2/h11,14H,6-10H2,1-5H3,(H,15,16)
InChIKeyMGMJKNIOJMIUKT-UHFFFAOYSA-N
MW228.38 g/mol
LogP2.32
Rot. Bonds8

About 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide

2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide (PubChem CID 103461265) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide.

Molecular Properties

Compound Name2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide
PubChem CID103461265
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC Name2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide
SMILESCCCC(C)NC(=O)CNCC(C)(C)CC
InChIInChI=1S/C13H28N2O/c1-6-8-11(3)15-12(16)9-14-10-13(4,5)7-2/h11,14H,6-10H2,1-5H3,(H,15,16)
InChIKeyMGMJKNIOJMIUKT-UHFFFAOYSA-N
XLogP2.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-2-(2,2-dimethylbutylamino)acetamide
CID 103461294
N-ethyl-2-[[2-oxo-2-(pentan-2-ylamino)ethyl]amino]acetamide
CID 60695403
N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 43179646
2-(3-hydroxybutylamino)-N-pentan-2-ylacetamide
CID 64911612
2-(cyclohexylmethylamino)-N-pentan-2-ylacetamide
CID 60687215
2-(2-methoxypropylamino)-N-pentan-2-ylacetamide
CID 102697868
N-cyclopropyl-2-(2,2-dimethylbutylamino)acetamide
CID 103698505
2-(2,2-dimethylbutylamino)-N-methyl-N-propan-2-ylacetamide
CID 103461330
2-(2,2-dimethylbutylamino)-N-phenylacetamide
CID 113242973
3-methyl-3-[[2-oxo-2-(pentan-2-ylamino)ethyl]amino]butanamide
CID 113429147
2-[(1-methylpyrazol-3-yl)amino]-N-pentan-2-ylacetamide
CID 79778666
2-(4-methoxybutylamino)-N-pentan-2-ylacetamide
CID 60976896

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide?
The IUPAC name of 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide (CID 103461265) is 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide.
What is the SMILES notation for 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide?
The canonical SMILES for 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide is CCCC(C)NC(=O)CNCC(C)(C)CC.
What is the InChIKey of 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide?
The InChIKey is MGMJKNIOJMIUKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-6-8-11(3)15-12(16)9-14-10-13(4,5)7-2/h11,14H,6-10H2,1-5H3,(H,15,16).
What are the key properties of 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide?
2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide has a molecular weight of 228.38 g/mol, XLogP of 2.32, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide is sourced from PubChem (CID 103461265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).