N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide

C11H24N2O2 — CID 106292285

IUPACN-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide
SMILESCCCC(C)(O)CNC(=O)C(C)CNC
InChIInChI=1S/C11H24N2O2/c1-5-6-11(3,15)8-13-10(14)9(2)7-12-4/h9,12,15H,5-8H2,1-4H3,(H,13,14)
InChIKeyHAERBFHOBLTMHP-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.51
Rot. Bonds7

About N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide

N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide (PubChem CID 106292285) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide
PubChem CID106292285
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide
SMILESCCCC(C)(O)CNC(=O)C(C)CNC
InChIInChI=1S/C11H24N2O2/c1-5-6-11(3,15)8-13-10(14)9(2)7-12-4/h9,12,15H,5-8H2,1-4H3,(H,13,14)
InChIKeyHAERBFHOBLTMHP-UHFFFAOYSA-N
XLogP0.51
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-hydroxy-2-methylpentyl)amino]-2-methyl-3-oxopropanoic acid
CID 106295623
(2R)-2-amino-N-(2-hydroxy-2-methylpentyl)-4-methylpentanamide
CID 106292244
2-methyl-3-(methylamino)-N-(2,2,4-trimethylpentyl)propanamide
CID 119820265
N-(2,3-dihydroxy-2-methylpropyl)-3-(ethylamino)-2-methylpropanamide
CID 66185352
4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide
CID 106295714
N-(5,5-dimethylhexyl)-2-methyl-3-(methylamino)propanamide
CID 119775757
2-amino-3,3,3-trifluoro-N-(2-hydroxy-2-methylpentyl)-2-methylpropanamide
CID 114169327
3-amino-N-(2-hydroxy-2-methylpentyl)-4-methylpentanamide
CID 106292069
2-methyl-N-[2-methyl-3-(methylamino)propyl]butanamide
CID 81478398
N-(2-ethyl-2-methylpentyl)-2-methylpropanamide
CID 89177449
N-[2-(4-chlorophenyl)-2-methylpropyl]-2-methyl-3-(methylamino)propanamide
CID 119738068
N-(3-hydroxy-2,3-dimethylbutan-2-yl)-2-methyl-3-(methylamino)propanamide
CID 106188163

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide?
The IUPAC name of N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide (CID 106292285) is N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide.
What is the SMILES notation for N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide?
The canonical SMILES for N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide is CCCC(C)(O)CNC(=O)C(C)CNC.
What is the InChIKey of N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide?
The InChIKey is HAERBFHOBLTMHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-5-6-11(3,15)8-13-10(14)9(2)7-12-4/h9,12,15H,5-8H2,1-4H3,(H,13,14).
What are the key properties of N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide?
N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide has a molecular weight of 216.32 g/mol, XLogP of 0.51, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 106292285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).