N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide

C13H29N3O — CID 43179646

IUPACN-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
SMILESCCC(C)NC(=O)CNCC(C)(C)CN(C)C
InChIInChI=1S/C13H29N3O/c1-7-11(2)15-12(17)8-14-9-13(3,4)10-16(5)6/h11,14H,7-10H2,1-6H3,(H,15,17)
InChIKeyFDMPOBXAWBRLET-UHFFFAOYSA-N
MW243.39 g/mol
LogP1.08
Rot. Bonds8

About N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide

N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide (PubChem CID 43179646) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
PubChem CID43179646
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC NameN-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
SMILESCCC(C)NC(=O)CNCC(C)(C)CN(C)C
InChIInChI=1S/C13H29N3O/c1-7-11(2)15-12(17)8-14-9-13(3,4)10-16(5)6/h11,14H,7-10H2,1-6H3,(H,15,17)
InChIKeyFDMPOBXAWBRLET-UHFFFAOYSA-N
XLogP1.08
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-butan-2-yl-2-(2,2-dimethylbutylamino)acetamide
CID 103461294
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(2-methylbutan-2-yl)acetamide
CID 60672282
N-butan-2-yl-2-[2-(dimethylamino)ethylamino]acetamide
CID 43180189
2-(2,2-dimethylbutylamino)-N-pentan-2-ylacetamide
CID 103461265
N-butan-2-yl-2-[[2-(tert-butylamino)-2-oxoethyl]amino]acetamide
CID 113219551
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 28572507
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-phenylacetamide
CID 28572618
N-[3-(dimethylamino)-2,2-dimethylpropyl]propanamide
CID 59842400
ethyl 2-[[2-(butan-2-ylamino)-2-oxoethyl]amino]acetate
CID 60811242
N-(2-cyanoethyl)-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide
CID 28572608
2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-N-(3-methylphenyl)acetamide
CID 28572661
N-butan-2-yl-2-[2-[cyclopropyl(methyl)amino]propylamino]acetamide
CID 114133096

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide?
The IUPAC name of N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide (CID 43179646) is N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide?
The canonical SMILES for N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide is CCC(C)NC(=O)CNCC(C)(C)CN(C)C.
What is the InChIKey of N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide?
The InChIKey is FDMPOBXAWBRLET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-7-11(2)15-12(17)8-14-9-13(3,4)10-16(5)6/h11,14H,7-10H2,1-6H3,(H,15,17).
What are the key properties of N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide?
N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide has a molecular weight of 243.39 g/mol, XLogP of 1.08, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]acetamide is sourced from PubChem (CID 43179646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).