1-hydroxy-3,3-dimethylpyrrolidine

C6H13NO — CID 119097491

IUPAC1-hydroxy-3,3-dimethylpyrrolidine
SMILESCC1(C)CCN(O)C1
InChIInChI=1S/C6H13NO/c1-6(2)3-4-7(8)5-6/h8H,3-5H2,1-2H3
InChIKeyHCTWEDGSZBQKJS-UHFFFAOYSA-N
MW115.18 g/mol
LogP1.11
Rot. Bonds

About 1-hydroxy-3,3-dimethylpyrrolidine

1-hydroxy-3,3-dimethylpyrrolidine (PubChem CID 119097491) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 1-hydroxy-3,3-dimethylpyrrolidine.

Molecular Properties

Compound Name1-hydroxy-3,3-dimethylpyrrolidine
PubChem CID119097491
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name1-hydroxy-3,3-dimethylpyrrolidine
SMILESCC1(C)CCN(O)C1
InChIInChI=1S/C6H13NO/c1-6(2)3-4-7(8)5-6/h8H,3-5H2,1-2H3
InChIKeyHCTWEDGSZBQKJS-UHFFFAOYSA-N
XLogP1.11
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-hydroxy-3,3-dimethylpyrrolidine with MolForge

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

Launch Full Analysis

Related Compounds

1-hydroxy-4,4-dimethylpiperidine
CID 90735582
1,3,3,5,7,7-hexamethyl-1,5-diazonane
CID 167025577
1-methanidyl-3,3-dimethylpyrrolidine
CID 59704518
methane;1,3,3-trimethylpyrrolidine
CID 158632756
3,3-dimethyl-1-sulfanylpyrrolidine
CID 143872157
1-hydroxy-2,2,4,4-tetramethylpiperidine
CID 66751522
methoxymethane;1,3,3-trimethylpyrrolidine
CID 166534043
N,3,3-trimethylpyrrolidin-1-amine
CID 143246340
1,11-dihydroxy-3,4,8,8,13,13,15,15-octamethyl-1,6,11-triazacyclohexadec-2-ene;ethane
CID 144511599
7-hydroxy-2-oxa-7-azaspiro[3.4]octane
CID 118202899
1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol
CID 115277650
ethane;methyl 3,3-dimethylpyrrolidine-1-carboxylate
CID 144942251

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-3,3-dimethylpyrrolidine?
The IUPAC name of 1-hydroxy-3,3-dimethylpyrrolidine (CID 119097491) is 1-hydroxy-3,3-dimethylpyrrolidine.
What is the SMILES notation for 1-hydroxy-3,3-dimethylpyrrolidine?
The canonical SMILES for 1-hydroxy-3,3-dimethylpyrrolidine is CC1(C)CCN(O)C1.
What is the InChIKey of 1-hydroxy-3,3-dimethylpyrrolidine?
The InChIKey is HCTWEDGSZBQKJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-6(2)3-4-7(8)5-6/h8H,3-5H2,1-2H3.
What are the key properties of 1-hydroxy-3,3-dimethylpyrrolidine?
1-hydroxy-3,3-dimethylpyrrolidine has a molecular weight of 115.18 g/mol, XLogP of 1.11, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-3,3-dimethylpyrrolidine is sourced from PubChem (CID 119097491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).