2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol

C9H19NO2 — CID 106939814

IUPAC2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol
SMILESCC(C)(O)COCC1CCNC1
InChIInChI=1S/C9H19NO2/c1-9(2,11)7-12-6-8-3-4-10-5-8/h8,10-11H,3-7H2,1-2H3
InChIKeyABBQYUWDCPNJRZ-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.38
Rot. Bonds4

About 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol

2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol (PubChem CID 106939814) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol
PubChem CID106939814
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol
SMILESCC(C)(O)COCC1CCNC1
InChIInChI=1S/C9H19NO2/c1-9(2,11)7-12-6-8-3-4-10-5-8/h8,10-11H,3-7H2,1-2H3
InChIKeyABBQYUWDCPNJRZ-UHFFFAOYSA-N
XLogP0.38
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-(piperidin-3-ylmethoxy)butan-2-ol
CID 106939384
(3S)-3-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
CID 94408814
4-(2,2-dimethylpropoxymethyl)piperidine
CID 26188639
(3S)-3-(cyclobutylmethoxymethyl)pyrrolidine
CID 86321931
3-(cyclopropylmethoxymethoxymethyl)pyrrolidine
CID 106938116
(3S)-3-(2-propoxyethoxymethyl)pyrrolidine
CID 86320893
3-(4-methoxybutoxymethyl)pyrrolidine
CID 104648277
3-(2-ethoxyethoxymethyl)pyrrolidine;hydrochloride
CID 56829885
N-(2-methylbutan-2-yl)-2-(pyrrolidin-3-ylmethoxy)acetamide
CID 62372287
(3R)-3-(2-fluoroethoxymethyl)pyrrolidine
CID 86320647
3-[(3-chloro-2-methylprop-2-enoxy)methyl]pyrrolidine
CID 106439115
3-(pentoxymethyl)pyrrolidine;hydrochloride
CID 53409474

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol?
The IUPAC name of 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol (CID 106939814) is 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol.
What is the SMILES notation for 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol?
The canonical SMILES for 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol is CC(C)(O)COCC1CCNC1.
What is the InChIKey of 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol?
The InChIKey is ABBQYUWDCPNJRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-9(2,11)7-12-6-8-3-4-10-5-8/h8,10-11H,3-7H2,1-2H3.
What are the key properties of 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol?
2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol has a molecular weight of 173.26 g/mol, XLogP of 0.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(pyrrolidin-3-ylmethoxy)propan-2-ol is sourced from PubChem (CID 106939814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).