methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate

C15H22N2O4 — CID 43431542

IUPACmethyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate
SMILESCCCC(C)(NC(=O)CCn1ccccc1=O)C(=O)OC
InChIInChI=1S/C15H22N2O4/c1-4-9-15(2,14(20)21-3)16-12(18)8-11-17-10-6-5-7-13(17)19/h5-7,10H,4,8-9,11H2,1-3H3,(H,16,18)
InChIKeyMTMRXRHWJQMUNU-UHFFFAOYSA-N
MW294.35 g/mol
LogP1.09
Rot. Bonds7

About methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate

methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate (PubChem CID 43431542) has the molecular formula C15H22N2O4 and a molecular weight of 294.35 g/mol. Its IUPAC name is methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate.

Molecular Properties

Compound Namemethyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate
PubChem CID43431542
Molecular FormulaC15H22N2O4
Molecular Weight294.35 g/mol
Exact Mass294.16
IUPAC Namemethyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate
SMILESCCCC(C)(NC(=O)CCn1ccccc1=O)C(=O)OC
InChIInChI=1S/C15H22N2O4/c1-4-9-15(2,14(20)21-3)16-12(18)8-11-17-10-6-5-7-13(17)19/h5-7,10H,4,8-9,11H2,1-3H3,(H,16,18)
InChIKeyMTMRXRHWJQMUNU-UHFFFAOYSA-N
XLogP1.09
TPSA77.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Methyl 2-methyl-2-[[2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetyl]amino]pentanoate
CID 86982612
Methyl 4-methyl-2-[[2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetyl]amino]pentanoate
CID 133819270
(2S)-4-methyl-2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]pentanoic acid
CID 119362151
Methyl 2-(3-amino-2-oxo-1-pyridinyl)-4-methylpentanoate
CID 167446055
methyl (2S)-2-(3-amino-2-oxo-1-pyridinyl)-4-methylpentanoate
CID 168106743
(3S)-3-[[1-(2-methoxy-2-oxoethyl)-6-oxo-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid
CID 170161715
3-[[1-(2-Methoxy-2-oxoethyl)-6-oxo-3-pyridinyl]carbamoyl]piperidine-1-carboxylic acid
CID 170162220
methyl (2S)-4-methyl-2-[(1-methyl-2-oxopyridine-3-carbonyl)amino]pentanoate
CID 172377239
4-Methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoic acid
CID 43170174
3-Methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoic acid
CID 43171232
2-Cyclopropyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]propanoic acid
CID 43172568
methyl 4-methyl-2-[(2-oxo-1H-pyridine-3-carbonyl)amino]pentanoate
CID 43406045

Frequently Asked Questions

What is the IUPAC name of methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate?
The IUPAC name of methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate (CID 43431542) is methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate.
What is the SMILES notation for methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate?
The canonical SMILES for methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate is CCCC(C)(NC(=O)CCn1ccccc1=O)C(=O)OC.
What is the InChIKey of methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate?
The InChIKey is MTMRXRHWJQMUNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O4/c1-4-9-15(2,14(20)21-3)16-12(18)8-11-17-10-6-5-7-13(17)19/h5-7,10H,4,8-9,11H2,1-3H3,(H,16,18).
What are the key properties of methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate?
methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate has a molecular weight of 294.35 g/mol, XLogP of 1.09, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-methyl-2-[3-(2-oxo-1-pyridinyl)propanoylamino]pentanoate is sourced from PubChem (CID 43431542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).