1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol

C10H21NO — CID 115277650

IUPAC1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol
SMILESCC(C)(O)CN1CCC(C)(C)C1
InChIInChI=1S/C10H21NO/c1-9(2)5-6-11(7-9)8-10(3,4)12/h12H,5-8H2,1-4H3
InChIKeyMRIVZUXMUCTROR-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.49
Rot. Bonds2

About 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol

1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol (PubChem CID 115277650) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol
PubChem CID115277650
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol
SMILESCC(C)(O)CN1CCC(C)(C)C1
InChIInChI=1S/C10H21NO/c1-9(2)5-6-11(7-9)8-10(3,4)12/h12H,5-8H2,1-4H3
InChIKeyMRIVZUXMUCTROR-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxy-4-methylpiperidin-1-yl)-2-methylpropan-2-ol
CID 130165718
1-(4,4-diethylpiperidin-1-yl)-2-methylpropan-2-ol
CID 63159462
1-(2-hydroxy-2-methylpropyl)-4,4-dimethylpyrrolidin-3-ol
CID 126992519
2-[2-(2-hydroxy-2-methylpropyl)-2,9-diazaspiro[5.5]undecan-9-yl]-N-methylacetamide
CID 97393800
1-(2-iodo-2,9-diazaspiro[5.5]undecan-9-yl)-2-methylpropan-2-ol
CID 175628880
4-(4,4-dimethylazepan-1-yl)-2-methylbutan-2-ol
CID 79361847
1-[(3,3-dimethylpyrrolidin-1-yl)methyl]cyclopentan-1-ol
CID 115825265
1-(2-chloroethyl)-3,3-dimethylpyrrolidine
CID 18182640
2-methyl-1-(1-pyrimidin-2-yl-1,7-diazaspiro[3.4]octan-7-yl)propan-2-ol
CID 134072685
[1-(2,2-dimethylpropyl)-3-methylpyrrolidin-3-yl]methanol
CID 130684841
3,3-dimethyl-1-(3,3,3-trifluoropropyl)pyrrolidine;ethane
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1-(4,4-dimethylpiperidin-1-yl)-2-phenylpropan-2-ol
CID 62931095

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol?
The IUPAC name of 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol (CID 115277650) is 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol.
What is the SMILES notation for 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol?
The canonical SMILES for 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol is CC(C)(O)CN1CCC(C)(C)C1.
What is the InChIKey of 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol?
The InChIKey is MRIVZUXMUCTROR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-9(2)5-6-11(7-9)8-10(3,4)12/h12H,5-8H2,1-4H3.
What are the key properties of 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol?
1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol has a molecular weight of 171.28 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-dimethylpyrrolidin-1-yl)-2-methylpropan-2-ol is sourced from PubChem (CID 115277650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).