5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide

C11H23N3O2 — CID 82012313

IUPAC5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide
SMILESCC(CN)CCC(=O)NC(C)C(=O)N(C)C
InChIInChI=1S/C11H23N3O2/c1-8(7-12)5-6-10(15)13-9(2)11(16)14(3)4/h8-9H,5-7,12H2,1-4H3,(H,13,15)
InChIKeyFLVGCOKQCOPPBG-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.05
Rot. Bonds6

About 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide

5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide (PubChem CID 82012313) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide
PubChem CID82012313
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide
SMILESCC(CN)CCC(=O)NC(C)C(=O)N(C)C
InChIInChI=1S/C11H23N3O2/c1-8(7-12)5-6-10(15)13-9(2)11(16)14(3)4/h8-9H,5-7,12H2,1-4H3,(H,13,15)
InChIKeyFLVGCOKQCOPPBG-UHFFFAOYSA-N
XLogP-0.05
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-aminopropanoylamino)-N,N-dimethylpropanamide
CID 43579388
methyl (2S)-2-[(5-amino-4-methylpentanoyl)amino]propanoate
CID 82011707
(2S)-2-[(5-amino-4-methylpentanoyl)amino]-3-methylbutanoic acid
CID 82010947
2-[3-(4-aminocyclohexyl)propanoylamino]-N,N-dimethylpropanamide
CID 55116663
2-[(5-amino-4-methylpentanoyl)amino]-3-hydroxybutanoic acid
CID 82012633
(2S)-2-[(5-amino-4-methylpentanoyl)amino]butanoic acid
CID 82689262
5-amino-N-heptan-2-yl-4-methylpentanamide
CID 82012192
3-[(5-amino-4-methylpentanoyl)amino]-4-methylpentanoic acid
CID 82687956
2-[3-(cyclopropylamino)propanoylamino]-N,N-dimethylpropanamide
CID 60867427
(2R)-2-[(5-amino-4-methylpentanoyl)amino]-4-methylpentanoic acid
CID 82012413
2-[(5-amino-4-methylpentanoyl)amino]-4-methylpentanoic acid
CID 82010708
2-[3-(2-aminophenyl)propanoylamino]-N,N-dimethylpropanamide
CID 61466661

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide?
The IUPAC name of 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide (CID 82012313) is 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide.
What is the SMILES notation for 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide?
The canonical SMILES for 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide is CC(CN)CCC(=O)NC(C)C(=O)N(C)C.
What is the InChIKey of 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide?
The InChIKey is FLVGCOKQCOPPBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-8(7-12)5-6-10(15)13-9(2)11(16)14(3)4/h8-9H,5-7,12H2,1-4H3,(H,13,15).
What are the key properties of 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide?
5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide has a molecular weight of 229.32 g/mol, XLogP of -0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-(dimethylamino)-1-oxopropan-2-yl]-4-methylpentanamide is sourced from PubChem (CID 82012313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).