2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide

C11H23N3O2 — CID 103810328

IUPAC2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
SMILESCCC(C)C(N)C(=O)N(C)CCC(=O)NC
InChIInChI=1S/C11H23N3O2/c1-5-8(2)10(12)11(16)14(4)7-6-9(15)13-3/h8,10H,5-7,12H2,1-4H3,(H,13,15)
InChIKeyGEQASTITUXDCDI-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.05
Rot. Bonds6

About 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide

2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide (PubChem CID 103810328) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide.

Molecular Properties

Compound Name2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
PubChem CID103810328
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
SMILESCCC(C)C(N)C(=O)N(C)CCC(=O)NC
InChIInChI=1S/C11H23N3O2/c1-5-8(2)10(12)11(16)14(4)7-6-9(15)13-3/h8,10H,5-7,12H2,1-4H3,(H,13,15)
InChIKeyGEQASTITUXDCDI-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-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]hexanamide
CID 103832738
2,3-dimethyl-4-[methyl-[3-(methylamino)-3-oxopropyl]amino]-4-oxobutanoic acid
CID 106914932
(2S,3S)-2-amino-N-(3-methoxypropyl)-N,3-dimethylpentanamide
CID 63009481
(2S)-2-amino-N-(2-cyanoethyl)-N,3-dimethylpentanamide
CID 61174046
2-amino-N,3-dimethyl-N-(2-methylsulfonylethyl)pentanamide
CID 79858979
4-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pentanamide
CID 106813309
2-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]pent-4-enamide
CID 106915272
2-amino-N-methyl-N-[3-(methylamino)-3-oxopropyl]-4-methylsulfonylbutanamide
CID 103827599
(2R)-2-cyclopentyloxy-N-methyl-N-[3-(methylamino)-3-oxopropyl]butanamide
CID 95625497
(2S)-2-amino-N-[2-(cyclopropylamino)-2-oxoethyl]-N,3-dimethylpentanamide
CID 61173174
3-[[(2S)-2-amino-3-methylpentanoyl]-ethylamino]propanoic acid
CID 62329160
(2S,3S)-2-amino-3-methyl-N,N-dipropylpentanamide
CID 42314652

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide?
The IUPAC name of 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide (CID 103810328) is 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide.
What is the SMILES notation for 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide?
The canonical SMILES for 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide is CCC(C)C(N)C(=O)N(C)CCC(=O)NC.
What is the InChIKey of 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide?
The InChIKey is GEQASTITUXDCDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-5-8(2)10(12)11(16)14(4)7-6-9(15)13-3/h8,10H,5-7,12H2,1-4H3,(H,13,15).
What are the key properties of 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide?
2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide 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 2-amino-N,3-dimethyl-N-[3-(methylamino)-3-oxopropyl]pentanamide is sourced from PubChem (CID 103810328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).