N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide

C13H29N3O — CID 62832837

IUPACN-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NCC(C)(C)CN(C)C
InChIInChI=1S/C13H29N3O/c1-8-15-13(4,5)11(17)14-9-12(2,3)10-16(6)7/h15H,8-10H2,1-7H3,(H,14,17)
InChIKeyQFBUULGHLBUFJU-UHFFFAOYSA-N
MW243.39 g/mol
LogP1.08
Rot. Bonds7

About N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide

N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide (PubChem CID 62832837) has the molecular formula C13H29N3O and a molecular weight of 243.39 g/mol. Its IUPAC name is N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide
PubChem CID62832837
Molecular FormulaC13H29N3O
Molecular Weight243.39 g/mol
Exact Mass243.23
IUPAC NameN-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide
SMILESCCNC(C)(C)C(=O)NCC(C)(C)CN(C)C
InChIInChI=1S/C13H29N3O/c1-8-15-13(4,5)11(17)14-9-12(2,3)10-16(6)7/h15H,8-10H2,1-7H3,(H,14,17)
InChIKeyQFBUULGHLBUFJU-UHFFFAOYSA-N
XLogP1.08
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
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

3-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-2,2-dimethyl-3-oxopropanoic acid
CID 82812631
2-amino-N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methylpropanamide;dihydrochloride
CID 119828440
N-[3-(dimethylamino)-2,2-dimethylpropyl]propanamide
CID 59842400
3-[[2-(ethylamino)-2-methylpropanoyl]amino]-2-hydroxy-2-methylpropanoic acid
CID 66176397
2-(ethylamino)-N-(2-methoxy-2-methylpropyl)-2-methylpropanamide
CID 104761328
3-[3-(dimethylamino)-2,2-dimethylpropyl]-1,1-diethylurea
CID 104624160
2-carbamothioyl-N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methylbutanamide
CID 113270438
2-(ethylamino)-N-[2-ethyl-2-(hydroxymethyl)butyl]-2-methylpropanamide
CID 106255258
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methylprop-2-enamide
CID 3018570
tert-butyl N-[3-(dimethylamino)-2,2-dimethylpropyl]carbamate
CID 65142819
2-(ethylamino)-2-methyl-N-prop-2-ynylpropanamide
CID 62832671
N-(cyanomethyl)-2-(ethylamino)-2-methylpropanamide
CID 62835754

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide?
The IUPAC name of N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide (CID 62832837) is N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide.
What is the SMILES notation for N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide?
The canonical SMILES for N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide is CCNC(C)(C)C(=O)NCC(C)(C)CN(C)C.
What is the InChIKey of N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide?
The InChIKey is QFBUULGHLBUFJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N3O/c1-8-15-13(4,5)11(17)14-9-12(2,3)10-16(6)7/h15H,8-10H2,1-7H3,(H,14,17).
What are the key properties of N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide?
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide has a molecular weight of 243.39 g/mol, XLogP of 1.08, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-(ethylamino)-2-methylpropanamide is sourced from PubChem (CID 62832837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).