N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide

C10H20N2O2 — CID 65106728

IUPACN-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide
SMILESCCC(C)(O)CNC(=O)C1CCNC1
InChIInChI=1S/C10H20N2O2/c1-3-10(2,14)7-12-9(13)8-4-5-11-6-8/h8,11,14H,3-7H2,1-2H3,(H,12,13)
InChIKeyZWQXPVZEUWLCMJ-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.13
Rot. Bonds4

About N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide

N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide (PubChem CID 65106728) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide
PubChem CID65106728
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide
SMILESCCC(C)(O)CNC(=O)C1CCNC1
InChIInChI=1S/C10H20N2O2/c1-3-10(2,14)7-12-9(13)8-4-5-11-6-8/h8,11,14H,3-7H2,1-2H3,(H,12,13)
InChIKeyZWQXPVZEUWLCMJ-UHFFFAOYSA-N
XLogP-0.13
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-3-methyl-4-(pyrrolidine-3-carbonylamino)butanoic acid
CID 66003959
N-(2-amino-2-methylpropyl)pyrrolidine-3-carboxamide
CID 83617629
2-hydroxy-2-methyl-3-(pyrrolidine-3-carbonylamino)propanoic acid
CID 66177040
N-(2-hydroxy-2-methylbutyl)-6-oxopiperidine-3-carboxamide
CID 79039671
3-hydroxy-3-methyl-4-[[(3R)-piperidine-3-carbonyl]amino]butanoic acid
CID 81133727
(3S)-N-(2-methylbutan-2-yl)pyrrolidine-3-carboxamide
CID 94915342
(3S)-N-(2-hydroxy-4-methoxy-2-methylbutyl)piperidine-3-carboxamide
CID 106254036
N-(2,2-difluoro-3-hydroxypropyl)pyrrolidine-3-carboxamide
CID 106176720
N-[2-methyl-2-(oxan-4-yl)propyl]pyrrolidine-3-carboxamide
CID 115159666
(3S)-N-[2-ethyl-2-(hydroxymethyl)butyl]piperidine-3-carboxamide
CID 114164701
N-(cyanomethyl)pyrrolidine-3-carboxamide
CID 63005211
N-(2-hydroxy-4-methoxy-2-methylbutyl)azetidine-3-carboxamide
CID 106254571

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide (CID 65106728) is N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide is CCC(C)(O)CNC(=O)C1CCNC1.
What is the InChIKey of N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide?
The InChIKey is ZWQXPVZEUWLCMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-10(2,14)7-12-9(13)8-4-5-11-6-8/h8,11,14H,3-7H2,1-2H3,(H,12,13).
What are the key properties of N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide?
N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide has a molecular weight of 200.28 g/mol, XLogP of -0.13, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-2-methylbutyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 65106728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).