3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide

C9H19N3O2 — CID 60970889

IUPAC3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide
SMILESCCN(CCC(N)=O)CC(=O)N(C)C
InChIInChI=1S/C9H19N3O2/c1-4-12(6-5-8(10)13)7-9(14)11(2)3/h4-7H2,1-3H3,(H2,10,13)
InChIKeyROBHCFVQZJWMFY-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.73
Rot. Bonds6

About 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide

3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide (PubChem CID 60970889) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide.

Molecular Properties

Compound Name3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide
PubChem CID60970889
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC Name3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide
SMILESCCN(CCC(N)=O)CC(=O)N(C)C
InChIInChI=1S/C9H19N3O2/c1-4-12(6-5-8(10)13)7-9(14)11(2)3/h4-7H2,1-3H3,(H2,10,13)
InChIKeyROBHCFVQZJWMFY-UHFFFAOYSA-N
XLogP-0.73
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]-N-methylpropanamide
CID 43588549
2-[3-aminopropyl(ethyl)amino]-N,N-dimethylacetamide
CID 43137216
3-[bis[3-(diethylamino)propyl]amino]propanamide
CID 87989478
3-[ethyl(2-hydroxyethyl)amino]propanamide
CID 39248219
2-[ethyl(2-methoxyethyl)amino]-N,N-dimethylacetamide
CID 135183389
3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide
CID 61351237
2-[2-(tert-butylamino)ethyl-ethylamino]-N,N-dimethylacetamide
CID 107446461
2-[3-(diethylamino)propyl-ethylamino]acetamide
CID 102996272
2-[(3-amino-3-sulfanylidenepropyl)-(2-methoxyethyl)amino]-N,N-dimethylacetamide
CID 63285324
2-[bis(2-hydroxyethyl)amino]-N,N-dimethylacetamide
CID 60686826
3-[bis[3-(dimethylamino)propyl]amino]propanamide
CID 3097429
methyl 2-[[4-(dimethylamino)-4-oxobutyl]-ethylamino]acetate
CID 62012741

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide?
The IUPAC name of 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide (CID 60970889) is 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide.
What is the SMILES notation for 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide?
The canonical SMILES for 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide is CCN(CCC(N)=O)CC(=O)N(C)C.
What is the InChIKey of 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide?
The InChIKey is ROBHCFVQZJWMFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-4-12(6-5-8(10)13)7-9(14)11(2)3/h4-7H2,1-3H3,(H2,10,13).
What are the key properties of 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide?
3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide has a molecular weight of 201.27 g/mol, XLogP of -0.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide is sourced from PubChem (CID 60970889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).