(3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol

C10H21NO — CID 168820539

IUPAC(3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol
SMILESCC(C)(C)N1CC[C@@H](O)C1(C)C
InChIInChI=1S/C10H21NO/c1-9(2,3)11-7-6-8(12)10(11,4)5/h8,12H,6-7H2,1-5H3/t8-/m1/s1
InChIKeySLKPHRGERKWVBO-MRVPVSSYSA-N
MW171.28 g/mol
LogP1.63
Rot. Bonds

About (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol

(3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol (PubChem CID 168820539) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol.

Molecular Properties

Compound Name(3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol
PubChem CID168820539
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol
SMILESCC(C)(C)N1CC[C@@H](O)C1(C)C
InChIInChI=1S/C10H21NO/c1-9(2,3)11-7-6-8(12)10(11,4)5/h8,12H,6-7H2,1-5H3/t8-/m1/s1
InChIKeySLKPHRGERKWVBO-MRVPVSSYSA-N
XLogP1.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-tert-butyl-N,2,2-trimethylpyrrolidin-3-amine
CID 117017087
1-(3-bromo-2,2-dimethylpropyl)-2,2-dimethylpyrrolidin-3-ol
CID 130658724
(4S)-1-tert-butyl-2,2,4-trimethylpiperidine
CID 177123867
3-hydroxy-2,2-dimethylpyrrolidine-1-carbonitrile
CID 127014466
2,2-dimethyl-1-[4-(trifluoromethyl)phenyl]pyrrolidin-3-ol
CID 117016861
5-tert-butyl-5-azaspiro[2.5]octan-8-ol
CID 130291196
1-cycloheptyl-2,2-dimethylpyrrolidin-3-ol
CID 117016811
1-(3-hydroxy-2,2-dimethylpyrrolidin-1-yl)but-2-yn-1-one
CID 130735696
1-(1-tert-butyl-2,2-dimethylpiperidin-3-yl)piperazine
CID 117019904
1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol
CID 117016800
2-cyclopentyl-1-(3-hydroxy-2,2-dimethylpyrrolidin-1-yl)ethanone
CID 115275051
1-[2-(aminomethyl)prop-2-enyl]-2,2-dimethylpyrrolidin-3-ol
CID 131114201

Frequently Asked Questions

What is the IUPAC name of (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol?
The IUPAC name of (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol (CID 168820539) is (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol.
What is the SMILES notation for (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol?
The canonical SMILES for (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol is CC(C)(C)N1CC[C@@H](O)C1(C)C.
What is the InChIKey of (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol?
The InChIKey is SLKPHRGERKWVBO-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(2,3)11-7-6-8(12)10(11,4)5/h8,12H,6-7H2,1-5H3/t8-/m1/s1.
What are the key properties of (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol?
(3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol has a molecular weight of 171.28 g/mol, XLogP of 1.63, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-tert-butyl-2,2-dimethylpyrrolidin-3-ol is sourced from PubChem (CID 168820539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).