2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide

C38H79N11O10 — CID 176672042

IUPAC2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide
SMILESCC(C)N(C)CC(=O)N(C)CC(=O)N(C)CC=O.CCN(C)C(=O)CN(C)C.CN.CN(C)CC(=O)N(C)CC=O.CN(C)CC=O.CN(C=O)CC(=O)N(C)CC=O
InChIInChI=1S/C12H23N3O3.C7H12N2O3.C7H14N2O2.C7H16N2O.C4H9NO.CH5N/c1-10(2)14(4)8-12(18)15(5)9-11(17)13(3)6-7-16;1-8(6-11)5-7(12)9(2)3-4-10;1-8(2)6-7(11)9(3)4-5-10;1-5-9(4)7(10)6-8(2)3;1-5(2)3-4-6;1-2/h7,10H,6,8-9H2,1-5H3;4,6H,3,5H2,1-2H3;5H,4,6H2,1-3H3;5-6H2,1-4H3;4H,3H2,1-2H3;2H2,1H3
InChIKeyREYQRYFXJISHCI-UHFFFAOYSA-N
MW850.12 g/mol
LogP-3.27
Rot. Bonds21

About 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide

2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide (PubChem CID 176672042) has the molecular formula C38H79N11O10 and a molecular weight of 850.12 g/mol. Its IUPAC name is 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide.

Molecular Properties

Compound Name2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide
PubChem CID176672042
Molecular FormulaC38H79N11O10
Molecular Weight850.12 g/mol
Exact Mass849.60
IUPAC Name2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide
SMILESCC(C)N(C)CC(=O)N(C)CC(=O)N(C)CC=O.CCN(C)C(=O)CN(C)C.CN.CN(C)CC(=O)N(C)CC=O.CN(C)CC=O.CN(C=O)CC(=O)N(C)CC=O
InChIInChI=1S/C12H23N3O3.C7H12N2O3.C7H14N2O2.C7H16N2O.C4H9NO.CH5N/c1-10(2)14(4)8-12(18)15(5)9-11(17)13(3)6-7-16;1-8(6-11)5-7(12)9(2)3-4-10;1-8(2)6-7(11)9(3)4-5-10;1-5-9(4)7(10)6-8(2)3;1-5(2)3-4-6;1-2/h7,10H,6,8-9H2,1-5H3;4,6H,3,5H2,1-2H3;5H,4,6H2,1-3H3;5-6H2,1-4H3;4H,3H2,1-2H3;2H2,1H3
InChIKeyREYQRYFXJISHCI-UHFFFAOYSA-N
XLogP-3.27
TPSA229.12 Ų
H-Bond Donors1
H-Bond Acceptors15
Rotatable Bonds21
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500850.12
LogP ≤ 5-3.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide with MolForge

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Related Compounds

tris(N-ethyl-2-[formyl(methyl)amino]-N-methylacetamide);N-[2-[ethyl(methyl)amino]-2-oxoethyl]-N-methyl-2-[methyl(propan-2-yl)amino]acetamide;2-[formyl(methyl)amino]acetic acid
CID 176672156
N-methyl-2-(methylamino)-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]acetamide
CID 176959929
N-butyl-2-[methyl-[2-[methyl-[2-[methyl(propan-2-yl)amino]acetyl]amino]acetyl]amino]acetamide
CID 177167159
N-(2-aminoethyl)formamide;[ethyl(methyl)amino]methanone;N-[2-[[2-[[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-[formyl(methyl)amino]-N-methylacetamide;fermium
CID 176959908
2-(dimethylamino)-N-methyl-N-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-[2-[methyl-(3-methyl-2-oxobutyl)amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-2-oxoethyl]acetamide
CID 178008256
2-[4-aminobutan-2-yl(methyl)amino]-N,N-diethylacetamide
CID 61453369
N-[2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-methylamino]-2-oxoethyl]-2-formamido-N-methylacetamide
CID 177177439
N-(2-hydroxypropyl)-N-methylpropanamide;N-methyl-N-(2-oxoethyl)propanamide
CID 54420661
N-ethyl-N-methyl-2-[methyl-[(E)-5-methyl-4-oxohex-2-enyl]amino]acetamide
CID 135165456
N-[2-[ethyl(methyl)amino]-2-oxoethyl]-N-methyl-2-[methyl(oxomethyl)amino]acetamide;fermium;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanol;6-[2-[2-[2-[2-[2-[2-[2-(methylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl-(2,3,4,6-tetrahydroxyhexyl)amino]hexane-1,3,4,5-tetrol
CID 171850451
ethyl N-methyl-N-(2-oxoethyl)carbamate
CID 126971639
2-[[2-[ethyl(methyl)amino]-2-oxoethyl]-propan-2-ylamino]acetic acid
CID 60839636

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide?
The IUPAC name of 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide (CID 176672042) is 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide.
What is the SMILES notation for 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide?
The canonical SMILES for 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide is CC(C)N(C)CC(=O)N(C)CC(=O)N(C)CC=O.CCN(C)C(=O)CN(C)C.CN.CN(C)CC(=O)N(C)CC=O.CN(C)CC=O.CN(C=O)CC(=O)N(C)CC=O.
What is the InChIKey of 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide?
The InChIKey is REYQRYFXJISHCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O3.C7H12N2O3.C7H14N2O2.C7H16N2O.C4H9NO.CH5N/c1-10(2)14(4)8-12(18)15(5)9-11(17)13(3)6-7-16;1-8(6-11)5-7(12)9(2)3-4-10;1-8(2)6-7(11)9(3)4-5-10;1-5-9(4)7(10)6-8(2)3;1-5(2)3-4-6;1-2/h7,10H,6,8-9H2,1-5H3;4,6H,3,5H2,1-2H3;5H,4,6H2,1-3H3;5-6H2,1-4H3;4H,3H2,1-2H3;2H2,1H3.
What are the key properties of 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide?
2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide has a molecular weight of 850.12 g/mol, XLogP of -3.27, 21 rotatable bonds, 1 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)acetaldehyde;2-(dimethylamino)-N-ethyl-N-methylacetamide;2-(dimethylamino)-N-methyl-N-(2-oxoethyl)acetamide;2-[formyl(methyl)amino]-N-methyl-N-(2-oxoethyl)acetamide;methanamine;N-methyl-N-[2-[methyl(2-oxoethyl)amino]-2-oxoethyl]-2-[methyl(propan-2-yl)amino]acetamide is sourced from PubChem (CID 176672042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).