N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide

C12H24N2O2 — CID 71910820

IUPACN,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCCC1C(C)(C)O
InChIInChI=1S/C12H24N2O2/c1-5-13(6-2)11(15)14-9-7-8-10(14)12(3,4)16/h10,16H,5-9H2,1-4H3
InChIKeyZSTCFEBNZOYZAL-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.68
Rot. Bonds3

About N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide

N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide (PubChem CID 71910820) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
PubChem CID71910820
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCCC1C(C)(C)O
InChIInChI=1S/C12H24N2O2/c1-5-13(6-2)11(15)14-9-7-8-10(14)12(3,4)16/h10,16H,5-9H2,1-4H3
InChIKeyZSTCFEBNZOYZAL-UHFFFAOYSA-N
XLogP1.68
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,1-N-diethylpiperidine-1,2-dicarboxamide
CID 115583146
N,N-diethyl-4-(2-hydroxypropan-2-yl)piperidine-1-carboxamide
CID 20644912
(2S)-1-[ethyl(propyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 61195285
1-[ethyl(2-methylprop-2-enyl)carbamoyl]pyrrolidine-2-carboxylic acid
CID 61184167
1-(2-aminoacetyl)-N,N-diethylpyrrolidine-2-carboxamide;hydrochloride
CID 119305869
N-cyclohexyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
CID 127775822
(5-ethyl-3-methylfuran-2-yl)-[2-(2-hydroxypropan-2-yl)pyrrolidin-1-yl]methanone
CID 84594570
N,N-diethyl-2-pyridin-4-ylpyrrolidine-1-carboxamide
CID 110871633
N,N-diethyl-2-(2-hydroxycyclopentyl)piperidine-1-carboxamide
CID 79545752
2-tert-butyl-N-methoxy-N-methylpyrrolidine-1-carboxamide
CID 155201079
6-[2-(2-hydroxypropan-2-yl)pyrrolidine-1-carbonyl]-2-propylpyridazin-3-one
CID 75431167
(2R)-N-(3-ethyl-1-methylpyrazol-4-yl)-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide
CID 97340363

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide (CID 71910820) is N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide is CCN(CC)C(=O)N1CCCC1C(C)(C)O.
What is the InChIKey of N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide?
The InChIKey is ZSTCFEBNZOYZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-5-13(6-2)11(15)14-9-7-8-10(14)12(3,4)16/h10,16H,5-9H2,1-4H3.
What are the key properties of N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide?
N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 1.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(2-hydroxypropan-2-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 71910820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).