1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine

C14H27NO — CID 155794097

IUPAC1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine
SMILESCC(C)(C)OCC1(N2CCCC2)CCCC1
InChIInChI=1S/C14H27NO/c1-13(2,3)16-12-14(8-4-5-9-14)15-10-6-7-11-15/h4-12H2,1-3H3
InChIKeyUIYHAAOSKYYNME-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.21
Rot. Bonds3

About 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine

1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine (PubChem CID 155794097) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine.

Molecular Properties

Compound Name1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine
PubChem CID155794097
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine
SMILESCC(C)(C)OCC1(N2CCCC2)CCCC1
InChIInChI=1S/C14H27NO/c1-13(2,3)16-12-14(8-4-5-9-14)15-10-6-7-11-15/h4-12H2,1-3H3
InChIKeyUIYHAAOSKYYNME-UHFFFAOYSA-N
XLogP3.21
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

8a-(methoxymethyl)-2,3,5,6,7,8-hexahydro-1H-indolizine;ethane
CID 164878560
(6S,8R)-1',1'-difluoro-8-[(2-methylpropan-2-yl)oxymethyl]spiro[2,3,5,7-tetrahydro-1H-pyrrolizine-6,2'-cyclopropane]
CID 169315600
3,3-difluoro-1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopropyl]pyrrolidine
CID 155794319
ethane;8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 168942817
1-[1-(2,2-dimethylpropyl)cyclopropyl]pyrrolidine
CID 155794244
ethane;1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethanol;2-methoxy-2-methylpropane;hydroiodide
CID 176943439
(3R,8S)-3-(3,3-dimethylbutyl)-8-[(2-methylpropan-2-yl)oxymethyl]-1,2,3,5,6,7-hexahydropyrrolizine
CID 176734725
1-[4-[(2-methylpropan-2-yl)oxy]butyl]-1-[(2-methylpropan-2-yl)oxymethyl]cyclopentane
CID 70930204
1-[[1-[(2-methylpropan-2-yl)oxymethyl]cyclobutyl]methyl]azetidine
CID 171611844
8-(prop-1-en-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 170726733
(1-piperidin-1-ylcycloheptyl)methanamine
CID 24703148
[1-(azepan-1-yl)cyclopentyl]methanol
CID 104549393

Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine?
The IUPAC name of 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine (CID 155794097) is 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine.
What is the SMILES notation for 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine?
The canonical SMILES for 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine is CC(C)(C)OCC1(N2CCCC2)CCCC1.
What is the InChIKey of 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine?
The InChIKey is UIYHAAOSKYYNME-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-13(2,3)16-12-14(8-4-5-9-14)15-10-6-7-11-15/h4-12H2,1-3H3.
What are the key properties of 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine?
1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine has a molecular weight of 225.38 g/mol, XLogP of 3.21, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2-methylpropan-2-yl)oxymethyl]cyclopentyl]pyrrolidine is sourced from PubChem (CID 155794097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).