2-(3-aminopropanoylamino)-N,N-dimethylpropanamide

C8H17N3O2 — CID 43579388

IUPAC2-(3-aminopropanoylamino)-N,N-dimethylpropanamide
SMILESCC(NC(=O)CCN)C(=O)N(C)C
InChIInChI=1S/C8H17N3O2/c1-6(8(13)11(2)3)10-7(12)4-5-9/h6H,4-5,9H2,1-3H3,(H,10,12)
InChIKeyLQRNOWRBZFQMJR-UHFFFAOYSA-N
MW187.24 g/mol
LogP-1.07
Rot. Bonds4

About 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide

2-(3-aminopropanoylamino)-N,N-dimethylpropanamide (PubChem CID 43579388) has the molecular formula C8H17N3O2 and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-(3-aminopropanoylamino)-N,N-dimethylpropanamide
PubChem CID43579388
Molecular FormulaC8H17N3O2
Molecular Weight187.24 g/mol
Exact Mass187.13
IUPAC Name2-(3-aminopropanoylamino)-N,N-dimethylpropanamide
SMILESCC(NC(=O)CCN)C(=O)N(C)C
InChIInChI=1S/C8H17N3O2/c1-6(8(13)11(2)3)10-7(12)4-5-9/h6H,4-5,9H2,1-3H3,(H,10,12)
InChIKeyLQRNOWRBZFQMJR-UHFFFAOYSA-N
XLogP-1.07
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide
CID 82012313
2-[3-(2-aminophenyl)propanoylamino]-N,N-dimethylpropanamide
CID 61466661
2-[3-(4-aminocyclohexyl)propanoylamino]-N,N-dimethylpropanamide
CID 55116663
ethyl 2-(3-aminopropanoylamino)propanoate
CID 61499067
2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide
CID 60867427
2-[3-(furan-2-yl)propanoylamino]-N,N-dimethylpropanamide
CID 47035846
6-amino-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-4,4-dimethylhexanamide
CID 103109224
3-amino-N-[(2R)-1-hydroxypropan-2-yl]propanamide
CID 93083457
3-amino-N-butan-2-ylpropanamide
CID 16784988
2-(4-aminobutanoylamino)-N,N,4-trimethylpentanamide
CID 43699929
2-[[2-(1-aminocyclopentyl)acetyl]amino]-N,N-dimethylpropanamide
CID 64685184
N-[1-(dimethylamino)-1-oxopropan-2-yl]-3-(ethylamino)butanamide
CID 62838445

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide?
The IUPAC name of 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide (CID 43579388) is 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide.
What is the SMILES notation for 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide?
The canonical SMILES for 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide is CC(NC(=O)CCN)C(=O)N(C)C.
What is the InChIKey of 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide?
The InChIKey is LQRNOWRBZFQMJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O2/c1-6(8(13)11(2)3)10-7(12)4-5-9/h6H,4-5,9H2,1-3H3,(H,10,12).
What are the key properties of 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide?
2-(3-aminopropanoylamino)-N,N-dimethylpropanamide has a molecular weight of 187.24 g/mol, XLogP of -1.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminopropanoylamino)-N,N-dimethylpropanamide is sourced from PubChem (CID 43579388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).