[4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol

C15H29NO2 — CID 83062160

IUPAC[4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol
SMILESCCCC1CCCCN1CC1(CO)CCOCC1
InChIInChI=1S/C15H29NO2/c1-2-5-14-6-3-4-9-16(14)12-15(13-17)7-10-18-11-8-15/h14,17H,2-13H2,1H3
InChIKeyKCLSTUSWSMBZEA-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.43
Rot. Bonds5

About [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol

[4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol (PubChem CID 83062160) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol.

Molecular Properties

Compound Name[4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol
PubChem CID83062160
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name[4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol
SMILESCCCC1CCCCN1CC1(CO)CCOCC1
InChIInChI=1S/C15H29NO2/c1-2-5-14-6-3-4-9-16(14)12-15(13-17)7-10-18-11-8-15/h14,17H,2-13H2,1H3
InChIKeyKCLSTUSWSMBZEA-UHFFFAOYSA-N
XLogP2.43
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanamine
CID 83061995
N-[[4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methyl]propan-2-amine
CID 83045767
[1-[[4-(hydroxymethyl)oxan-4-yl]methyl]azepan-2-yl]methanol
CID 116638263
4-[(2-propylpiperidin-1-yl)methyl]oxane-4-carboxylic acid
CID 83061533
[3-[(2-ethylpiperidin-1-yl)methyl]oxetan-3-yl]methanol
CID 111976477
2-[1-[[4-[(cyclopropylamino)methyl]oxan-4-yl]methyl]piperidin-2-yl]ethanol
CID 62390771
1-[[1-(bromomethyl)cyclobutyl]methyl]-2-propylpiperidine
CID 83062041
3-[1-[[4-(ethylaminomethyl)oxan-4-yl]methyl]pyrrolidin-2-yl]propan-1-ol
CID 62479395
2-propyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine
CID 83055880
N-[[3-[(2-propylpiperidin-1-yl)methyl]oxan-3-yl]methyl]cyclopropanamine
CID 83045766
1-[4-[(2-ethylpyrrolidin-1-yl)methyl]oxan-4-yl]-N-methylmethanamine
CID 62392836
2-[1-[[1-(propylaminomethyl)cyclopentyl]methyl]piperidin-2-yl]ethanol
CID 62261936

Frequently Asked Questions

What is the IUPAC name of [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol?
The IUPAC name of [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol (CID 83062160) is [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol.
What is the SMILES notation for [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol?
The canonical SMILES for [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol is CCCC1CCCCN1CC1(CO)CCOCC1.
What is the InChIKey of [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol?
The InChIKey is KCLSTUSWSMBZEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-2-5-14-6-3-4-9-16(14)12-15(13-17)7-10-18-11-8-15/h14,17H,2-13H2,1H3.
What are the key properties of [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol?
[4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol has a molecular weight of 255.40 g/mol, XLogP of 2.43, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-propylpiperidin-1-yl)methyl]oxan-4-yl]methanol is sourced from PubChem (CID 83062160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).