(2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol

C10H21NO — CID 130161383

IUPAC(2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol
SMILESCC[C@@H](O)CN1CCCC1(C)C
InChIInChI=1S/C10H21NO/c1-4-9(12)8-11-7-5-6-10(11,2)3/h9,12H,4-8H2,1-3H3/t9-/m1/s1
InChIKeyRWQIHUAOFAWDND-SECBINFHSA-N
MW171.28 g/mol
LogP1.63
Rot. Bonds3

About (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol

(2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol (PubChem CID 130161383) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol.

Molecular Properties

Compound Name(2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol
PubChem CID130161383
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name(2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol
SMILESCC[C@@H](O)CN1CCCC1(C)C
InChIInChI=1S/C10H21NO/c1-4-9(12)8-11-7-5-6-10(11,2)3/h9,12H,4-8H2,1-3H3/t9-/m1/s1
InChIKeyRWQIHUAOFAWDND-SECBINFHSA-N
XLogP1.63
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
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

Analyze (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol?
The IUPAC name of (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol (CID 130161383) is (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol.
What is the SMILES notation for (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol?
The canonical SMILES for (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol is CC[C@@H](O)CN1CCCC1(C)C.
What is the InChIKey of (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol?
The InChIKey is RWQIHUAOFAWDND-SECBINFHSA-N. The full InChI is InChI=1S/C10H21NO/c1-4-9(12)8-11-7-5-6-10(11,2)3/h9,12H,4-8H2,1-3H3/t9-/m1/s1.
What are the key properties of (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol?
(2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol has a molecular weight of 171.28 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2,2-dimethylpyrrolidin-1-yl)butan-2-ol is sourced from PubChem (CID 130161383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).