5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide

C11H22N2O3 — CID 79198624

IUPAC5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
SMILESCC(C)NC(=O)CN(C)C(=O)CCCCO
InChIInChI=1S/C11H22N2O3/c1-9(2)12-10(15)8-13(3)11(16)6-4-5-7-14/h9,14H,4-8H2,1-3H3,(H,12,15)
InChIKeyHGZGXMHFTUOWOH-UHFFFAOYSA-N
MW230.31 g/mol
LogP0.13
Rot. Bonds7

About 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide

5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide (PubChem CID 79198624) has the molecular formula C11H22N2O3 and a molecular weight of 230.31 g/mol. Its IUPAC name is 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide.

Molecular Properties

Compound Name5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
PubChem CID79198624
Molecular FormulaC11H22N2O3
Molecular Weight230.31 g/mol
Exact Mass230.16
IUPAC Name5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide
SMILESCC(C)NC(=O)CN(C)C(=O)CCCCO
InChIInChI=1S/C11H22N2O3/c1-9(2)12-10(15)8-13(3)11(16)6-4-5-7-14/h9,14H,4-8H2,1-3H3,(H,12,15)
InChIKeyHGZGXMHFTUOWOH-UHFFFAOYSA-N
XLogP0.13
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide;hydrochloride
CID 119272108
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]acetamide
CID 60661823
5-hydroxy-N-(2-hydroxypropyl)-N-methylpentanamide
CID 79199467
2-[methyl(methylcarbamoyl)amino]-N-propan-2-ylacetamide
CID 115575214
(2R)-2-[[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]amino]propanoic acid
CID 78973916
2-amino-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 60937489
5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide
CID 139993140
3-amino-N,3-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]butanamide
CID 64685273
3-chloro-N,2,2-trimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 63679818
5-hydroxy-N-[3-oxo-3-(propan-2-ylamino)propyl]pentanamide
CID 112549766
2-bromo-N,2-dimethyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 114328087
ethane;2-[methyl-[2-[methyl(propyl)amino]acetyl]amino]-N-propan-2-ylacetamide
CID 142388460

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide?
The IUPAC name of 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide (CID 79198624) is 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide.
What is the SMILES notation for 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide?
The canonical SMILES for 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide is CC(C)NC(=O)CN(C)C(=O)CCCCO.
What is the InChIKey of 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide?
The InChIKey is HGZGXMHFTUOWOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3/c1-9(2)12-10(15)8-13(3)11(16)6-4-5-7-14/h9,14H,4-8H2,1-3H3,(H,12,15).
What are the key properties of 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide?
5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide has a molecular weight of 230.31 g/mol, XLogP of 0.13, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]pentanamide is sourced from PubChem (CID 79198624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).