3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide

C9H21N3O — CID 61351237

IUPAC3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide
SMILESCCN(CCN)CCC(=O)N(C)C
InChIInChI=1S/C9H21N3O/c1-4-12(8-6-10)7-5-9(13)11(2)3/h4-8,10H2,1-3H3
InChIKeyDRSLRWXJVFFTEF-UHFFFAOYSA-N
MW187.29 g/mol
LogP-0.25
Rot. Bonds6

About 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide

3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide (PubChem CID 61351237) has the molecular formula C9H21N3O and a molecular weight of 187.29 g/mol. Its IUPAC name is 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide
PubChem CID61351237
Molecular FormulaC9H21N3O
Molecular Weight187.29 g/mol
Exact Mass187.17
IUPAC Name3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide
SMILESCCN(CCN)CCC(=O)N(C)C
InChIInChI=1S/C9H21N3O/c1-4-12(8-6-10)7-5-9(13)11(2)3/h4-8,10H2,1-3H3
InChIKeyDRSLRWXJVFFTEF-UHFFFAOYSA-N
XLogP-0.25
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.29
LogP ≤ 5-0.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-aminoethyl(2,2,2-trifluoroethyl)amino]-N,N-dimethylpropanamide
CID 107494870
N-(3-aminopropyl)-3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]-N-methylpropanamide
CID 43588549
acetic acid;N',N'-diethylethane-1,2-diamine
CID 175226296
3-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]propanamide
CID 60970889
2-[3-aminopropyl(ethyl)amino]-N,N-dimethylacetamide
CID 43137216
N'-[2-[bis(2-aminoethyl)amino]ethyl]-N'-ethylethane-1,2-diamine
CID 157466747
N'-[2-(dimethylamino)ethyl]-N'-ethylethane-1,2-diamine;ethane
CID 143734586
3-[2-aminoethyl(ethyl)amino]-N-cyclopropylpropanamide
CID 62626817
2-[2-aminoethyl(ethyl)amino]acetic acid
CID 22667567
N-(3-aminopropyl)-3-[ethyl(2-ethylbutyl)amino]-N-methylpropanamide
CID 43588424
CID 172703845
CID 172703845
3-(dimethylamino)-N,N-dimethylpropanamide;hydrochloride
CID 146155865

Frequently Asked Questions

What is the IUPAC name of 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide?
The IUPAC name of 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide (CID 61351237) is 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide is CCN(CCN)CCC(=O)N(C)C.
What is the InChIKey of 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide?
The InChIKey is DRSLRWXJVFFTEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O/c1-4-12(8-6-10)7-5-9(13)11(2)3/h4-8,10H2,1-3H3.
What are the key properties of 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide?
3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide has a molecular weight of 187.29 g/mol, XLogP of -0.25, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-aminoethyl(ethyl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 61351237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).