2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide

C15H29N3O4 — CID 143962924

IUPAC2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide
SMILESCCCCC(C(C)=O)N(C)C(=O)CN(C)C(=O)C(N)C(C)O
InChIInChI=1S/C15H29N3O4/c1-6-7-8-12(10(2)19)18(5)13(21)9-17(4)15(22)14(16)11(3)20/h11-12,14,20H,6-9,16H2,1-5H3
InChIKeyGQWSSNOZMCZVDG-UHFFFAOYSA-N
MW315.41 g/mol
LogP-0.24
Rot. Bonds9

About 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide

2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide (PubChem CID 143962924) has the molecular formula C15H29N3O4 and a molecular weight of 315.41 g/mol. Its IUPAC name is 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide.

Molecular Properties

Compound Name2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide
PubChem CID143962924
Molecular FormulaC15H29N3O4
Molecular Weight315.41 g/mol
Exact Mass315.22
IUPAC Name2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide
SMILESCCCCC(C(C)=O)N(C)C(=O)CN(C)C(=O)C(N)C(C)O
InChIInChI=1S/C15H29N3O4/c1-6-7-8-12(10(2)19)18(5)13(21)9-17(4)15(22)14(16)11(3)20/h11-12,14,20H,6-9,16H2,1-5H3
InChIKeyGQWSSNOZMCZVDG-UHFFFAOYSA-N
XLogP-0.24
TPSA103.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.41
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide 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

(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N,3-dimethylbutanamide;hydrochloride
CID 119270119
(2S)-N-methyl-2-(methylamino)-N-[2-[methyl-[(3S)-5-methyl-2-oxohexan-3-yl]amino]-2-oxoethyl]butanamide
CID 90163810
2-amino-N,3-dimethyl-N-(2-oxopropyl)butanamide;ethane
CID 143701294
(2S)-2-amino-N-[2-(dimethylamino)-2-oxoethyl]-N-methylpentanamide
CID 107568202
(2S)-2-amino-N,3-dimethyl-N-pentan-2-ylbutanamide
CID 61154897
2-amino-N-(1-hydroxypropan-2-yl)-N-methylhexanamide
CID 104551721
methyl 2-[acetyl(methyl)amino]hexanoate
CID 23279435
(2S)-2-amino-N-[2-[cyclohexyl(methyl)amino]-2-oxoethyl]-N-methylhexanamide
CID 103831373
(3S)-2-amino-N-[2-[[2-[[1-cyclohexyl-3-[methyl-[2-[(2-methylpropan-2-yl)oxy]prop-2-enyl]amino]but-3-en-2-yl]-methylamino]-2-oxoethyl]-methylamino]prop-2-enyl]-N,3-dimethylpentanamide
CID 167226879
(2R)-2-amino-N,N-dimethylhexanamide
CID 87696829
(2S)-2-amino-N-butyl-N-methylhexanamide
CID 103830866
ethyl 2-methylhexanoate
CID 12714009

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide?
The IUPAC name of 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide (CID 143962924) is 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide.
What is the SMILES notation for 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide?
The canonical SMILES for 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide is CCCCC(C(C)=O)N(C)C(=O)CN(C)C(=O)C(N)C(C)O.
What is the InChIKey of 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide?
The InChIKey is GQWSSNOZMCZVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O4/c1-6-7-8-12(10(2)19)18(5)13(21)9-17(4)15(22)14(16)11(3)20/h11-12,14,20H,6-9,16H2,1-5H3.
What are the key properties of 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide?
2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide has a molecular weight of 315.41 g/mol, XLogP of -0.24, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-hydroxy-N-methyl-N-[2-[methyl(2-oxoheptan-3-yl)amino]-2-oxoethyl]butanamide is sourced from PubChem (CID 143962924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).