N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide

C11H20N2O3 — CID 79382298

IUPACN-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide
SMILESCN1CC(C(=O)N(C)CC(C)(C)O)CC1=O
InChIInChI=1S/C11H20N2O3/c1-11(2,16)7-13(4)10(15)8-5-9(14)12(3)6-8/h8,16H,5-7H2,1-4H3
InChIKeyQNUFSAKIAHHXRD-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.31
Rot. Bonds3

About N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide

N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide (PubChem CID 79382298) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide
PubChem CID79382298
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC NameN-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide
SMILESCN1CC(C(=O)N(C)CC(C)(C)O)CC1=O
InChIInChI=1S/C11H20N2O3/c1-11(2,16)7-13(4)10(15)8-5-9(14)12(3)6-8/h8,16H,5-7H2,1-4H3
InChIKeyQNUFSAKIAHHXRD-UHFFFAOYSA-N
XLogP-0.31
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-2-methylpropyl)-N-methyl-5-oxo-1-(2-phenylethyl)pyrrolidine-3-carboxamide
CID 111543092
4-[[methyl-(1-methyl-5-oxopyrrolidine-3-carbonyl)amino]methyl]benzoic acid
CID 60754710
N-(2-hydroxy-3-methoxypropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide
CID 54993619
(3R)-N,1-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 94099738
N-(3-amino-2,2-dimethylpropyl)-1-[2-(dimethylamino)ethyl]-N-methyl-5-oxopyrrolidine-3-carboxamide;dihydrochloride
CID 119654808
2-[ethyl-(1-methyl-5-oxopyrrolidine-3-carbonyl)amino]acetic acid
CID 61022712
(3R)-N-[(2,4-dimethoxyphenyl)methyl]-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide
CID 94090987
4-[4-(2-hydroxy-2-methylpropyl)piperazine-1-carbonyl]-1-methylpyrrolidin-2-one
CID 63655372
1-(2-methoxyethyl)-N-methyl-5-oxo-N-(2,2,2-trifluoroethyl)pyrrolidine-3-carboxamide
CID 131946273
1-methyl-5-oxopyrrolidine-3-carboxamide
CID 541476
2,2-dimethylpropane;[3-(1-methyl-5-oxopyrrolidine-3-carbonyl)oxy-2,2-bis[(1-methyl-5-oxopyrrolidine-3-carbonyl)oxymethyl]propyl] 1-methyl-5-oxopyrrolidine-3-carboxylate
CID 173112698
N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide
CID 79381210

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide (CID 79382298) is N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide is CN1CC(C(=O)N(C)CC(C)(C)O)CC1=O.
What is the InChIKey of N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide?
The InChIKey is QNUFSAKIAHHXRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-11(2,16)7-13(4)10(15)8-5-9(14)12(3)6-8/h8,16H,5-7H2,1-4H3.
What are the key properties of N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide?
N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide has a molecular weight of 228.29 g/mol, XLogP of -0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylpropyl)-N,1-dimethyl-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 79382298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).