N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide

C11H22N2O — CID 103461668

IUPACN-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide
SMILESCCC(C)(C)CNC(=O)C1CCCN1
InChIInChI=1S/C11H22N2O/c1-4-11(2,3)8-13-10(14)9-6-5-7-12-9/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKeyUVVRBZLPDRWVNP-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.29
Rot. Bonds4

About N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide

N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide (PubChem CID 103461668) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide
PubChem CID103461668
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC NameN-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide
SMILESCCC(C)(C)CNC(=O)C1CCCN1
InChIInChI=1S/C11H22N2O/c1-4-11(2,3)8-13-10(14)9-6-5-7-12-9/h9,12H,4-8H2,1-3H3,(H,13,14)
InChIKeyUVVRBZLPDRWVNP-UHFFFAOYSA-N
XLogP1.29
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-[[[(2R)-pyrrolidine-2-carbonyl]amino]methyl]butanoic acid
CID 104901372
(2R)-N-(4-hydroxy-2,2-dimethylbutyl)piperidine-2-carboxamide
CID 106147826
N-(2,2-dimethylbutyl)-4-methylpiperidine-2-carboxamide
CID 103461667
N-(2-methyl-2-methylsulfanylpropyl)pyrrolidine-2-carboxamide
CID 115666735
N-(2,3-dihydroxy-2-methylpropyl)pyrrolidine-2-carboxamide
CID 66188372
N-(2,2-diethylbutyl)piperidine-2-carboxamide;hydrochloride
CID 119345447
2-hydroxy-2-methyl-3-[[(2R)-pyrrolidine-2-carbonyl]amino]propanoic acid
CID 104901235
(2R)-N-[2,2-dimethyl-3-(methylamino)-3-oxopropyl]pyrrolidine-2-carboxamide
CID 106276954
(2R)-N-ethylpyrrolidine-2-carboxamide;molecular hydrogen
CID 178045420
N-propylpyrrolidine-2-carboxamide
CID 4984185
(2S)-N-(2,2-difluoro-3-hydroxypropyl)pyrrolidine-2-carboxamide
CID 106176647
(2S)-N-(1-hydroxy-3-methylpentan-3-yl)pyrrolidine-2-carboxamide
CID 106176083

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide (CID 103461668) is N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide is CCC(C)(C)CNC(=O)C1CCCN1.
What is the InChIKey of N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide?
The InChIKey is UVVRBZLPDRWVNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-4-11(2,3)8-13-10(14)9-6-5-7-12-9/h9,12H,4-8H2,1-3H3,(H,13,14).
What are the key properties of N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide?
N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide has a molecular weight of 198.31 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylbutyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 103461668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).