2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide

C24H46N4O6 — CID 158166842

IUPAC2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide
SMILESCCCC(C)C(=O)C(=O)NCC(=O)NC(C)C.CCCC(C)C(O)C(=O)NCC(=O)NC(C)C
InChIInChI=1S/C12H24N2O3.C12H22N2O3/c2*1-5-6-9(4)11(16)12(17)13-7-10(15)14-8(2)3/h8-9,11,16H,5-7H2,1-4H3,(H,13,17)(H,14,15);8-9H,5-7H2,1-4H3,(H,13,17)(H,14,15)
InChIKeyFWYGJBLNDZPOOG-UHFFFAOYSA-N
MW486.65 g/mol
LogP1.06
Rot. Bonds14

About 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide

2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide (PubChem CID 158166842) has the molecular formula C24H46N4O6 and a molecular weight of 486.65 g/mol. Its IUPAC name is 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide.

Molecular Properties

Compound Name2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide
PubChem CID158166842
Molecular FormulaC24H46N4O6
Molecular Weight486.65 g/mol
Exact Mass486.34
IUPAC Name2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide
SMILESCCCC(C)C(=O)C(=O)NCC(=O)NC(C)C.CCCC(C)C(O)C(=O)NCC(=O)NC(C)C
InChIInChI=1S/C12H24N2O3.C12H22N2O3/c2*1-5-6-9(4)11(16)12(17)13-7-10(15)14-8(2)3/h8-9,11,16H,5-7H2,1-4H3,(H,13,17)(H,14,15);8-9H,5-7H2,1-4H3,(H,13,17)(H,14,15)
InChIKeyFWYGJBLNDZPOOG-UHFFFAOYSA-N
XLogP1.06
TPSA153.70 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.65
LogP ≤ 51.06
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide 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

3-amino-2-hydroxy-N-[2-oxo-2-(1-phenylethylamino)ethyl]hexanamide;3-amino-2-oxo-N-[2-oxo-2-(1-phenylethylamino)ethyl]hexanamide;2-[(2-hydroxy-3-methylhexanoyl)amino]acetic acid;2-hydroxy-3-methyl-N-[2-oxo-2-(1-phenylethylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(1-phenylethylamino)ethyl]hexanamide
CID 91486659
tert-butyl 2-[(2-hydroxy-3-methylhexanoyl)amino]acetate
CID 20810601
N-(2,2-dihydroxyethyl)-2-hydroxy-3-methylhexanamide
CID 59918479
2-methyl-N-propan-2-ylpentanamide
CID 4628268
(2S)-2-amino-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
CID 61173876
3-amino-2-hydroxy-N-[2-[[(1S)-2-(methylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]hexanamide;2-hydroxy-3-methyl-N-[2-[[(1S)-2-(methylamino)-2-oxo-1-phenylethyl]amino]-2-oxoethyl]hexanamide;hydrochloride
CID 159999863
(3S)-3-amino-N-[2-[[(2S)-1-(dimethylamino)-3-methyl-1-oxobutan-2-yl]amino]-2-oxoethyl]-2-hydroxyhexanamide
CID 87495872
ethane;(2R)-N-[2-oxo-2-(propan-2-ylamino)ethyl]-2-sulfanylpropanamide
CID 145330870
2-(methylamino)-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 62639289
2-(pentan-2-ylamino)-N-propan-2-ylacetamide
CID 43179512
2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-pentan-2-ylpropanamide
CID 43420332
2,3-dimethyl-4-oxo-4-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]butanoic acid
CID 103496290

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide?
The IUPAC name of 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide (CID 158166842) is 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide.
What is the SMILES notation for 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide?
The canonical SMILES for 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide is CCCC(C)C(=O)C(=O)NCC(=O)NC(C)C.CCCC(C)C(O)C(=O)NCC(=O)NC(C)C.
What is the InChIKey of 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide?
The InChIKey is FWYGJBLNDZPOOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3.C12H22N2O3/c2*1-5-6-9(4)11(16)12(17)13-7-10(15)14-8(2)3/h8-9,11,16H,5-7H2,1-4H3,(H,13,17)(H,14,15);8-9H,5-7H2,1-4H3,(H,13,17)(H,14,15).
What are the key properties of 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide?
2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide has a molecular weight of 486.65 g/mol, XLogP of 1.06, 14 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide;3-methyl-2-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]hexanamide is sourced from PubChem (CID 158166842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).