1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol

C16H23NO2 — CID 117408226

IUPAC1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol
SMILESCN1CCCC(Oc2ccc(CC3(O)CC3)cc2)C1
InChIInChI=1S/C16H23NO2/c1-17-10-2-3-15(12-17)19-14-6-4-13(5-7-14)11-16(18)8-9-16/h4-7,15,18H,2-3,8-12H2,1H3
InChIKeyRWOFPWCIVFHQSV-UHFFFAOYSA-N
MW261.36 g/mol
LogP2.23
Rot. Bonds4

About 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol

1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol (PubChem CID 117408226) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol
PubChem CID117408226
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC Name1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol
SMILESCN1CCCC(Oc2ccc(CC3(O)CC3)cc2)C1
InChIInChI=1S/C16H23NO2/c1-17-10-2-3-15(12-17)19-14-6-4-13(5-7-14)11-16(18)8-9-16/h4-7,15,18H,2-3,8-12H2,1H3
InChIKeyRWOFPWCIVFHQSV-UHFFFAOYSA-N
XLogP2.23
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-(1-methylpiperidin-3-yl)oxyphenyl]butanoic acid
CID 117444593
2-[1-[4-(1-methylpiperidin-3-yl)oxyphenyl]cyclopropyl]acetic acid
CID 117467649
1-[[3-methoxy-2-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol
CID 117470886
ethane;1-methyl-3-phenoxypiperidine
CID 176561362
[4-(1-methylpyrrolidin-3-yl)oxyphenyl]methanamine
CID 117052585
1-[1-[4-(1-methylpiperidin-3-yl)oxyphenyl]cyclopropyl]ethanamine
CID 117438916
1-methyl-3-[4-(2-methylpyrrolidin-2-yl)phenoxy]piperidine
CID 117438903
1-methyl-3-[4-[(E)-2-phenylethenyl]phenoxy]piperidine
CID 134126069
3-methyl-3-[4-(1-methylpiperidin-3-yl)oxyphenyl]butanoic acid
CID 117470826
3-[4-(1-methylazepan-4-yl)oxyphenyl]propan-1-amine
CID 117095267
[4-(1-methylpiperidin-4-yl)oxyphenyl]methanol
CID 84686879
1-[3-(1-methylpiperidin-3-yl)oxyphenyl]propan-2-ol
CID 115005736

Frequently Asked Questions

What is the IUPAC name of 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol?
The IUPAC name of 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol (CID 117408226) is 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol is CN1CCCC(Oc2ccc(CC3(O)CC3)cc2)C1.
What is the InChIKey of 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol?
The InChIKey is RWOFPWCIVFHQSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-17-10-2-3-15(12-17)19-14-6-4-13(5-7-14)11-16(18)8-9-16/h4-7,15,18H,2-3,8-12H2,1H3.
What are the key properties of 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol?
1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol has a molecular weight of 261.36 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(1-methylpiperidin-3-yl)oxyphenyl]methyl]cyclopropan-1-ol is sourced from PubChem (CID 117408226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).