4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol

C15H21N5O2 — CID 95222707

IUPAC4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol
SMILESC[C@H](c1ccccc1)n1nnnc1N1CCC(O)(CO)CC1
InChIInChI=1S/C15H21N5O2/c1-12(13-5-3-2-4-6-13)20-14(16-17-18-20)19-9-7-15(22,11-21)8-10-19/h2-6,12,21-22H,7-11H2,1H3/t12-/m1/s1
InChIKeyQUCXBQJLXJLZJI-GFCCVEGCSA-N
MW303.37 g/mol
LogP0.61
Rot. Bonds4

About 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol

4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol (PubChem CID 95222707) has the molecular formula C15H21N5O2 and a molecular weight of 303.37 g/mol. Its IUPAC name is 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol.

Molecular Properties

Compound Name4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol
PubChem CID95222707
Molecular FormulaC15H21N5O2
Molecular Weight303.37 g/mol
Exact Mass303.17
IUPAC Name4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol
SMILESC[C@H](c1ccccc1)n1nnnc1N1CCC(O)(CO)CC1
InChIInChI=1S/C15H21N5O2/c1-12(13-5-3-2-4-6-13)20-14(16-17-18-20)19-9-7-15(22,11-21)8-10-19/h2-6,12,21-22H,7-11H2,1H3/t12-/m1/s1
InChIKeyQUCXBQJLXJLZJI-GFCCVEGCSA-N
XLogP0.61
TPSA87.30 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.37
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

4-(hydroxymethyl)-1-[1-[(1S)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol
CID 95222706
1'-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]spiro[1H-indole-3,4'-piperidine]-2-one
CID 95725644
1-(1-phenylethyl)tetrazol-5-amine
CID 19981424
[5-methyl-1-(1-phenylethyl)triazol-4-yl]methanol
CID 82206167
N-[1-[1-(1-phenylethyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103085388
3-[1-(1-phenylethyl)tetrazol-5-yl]propan-1-amine
CID 82228413
5-(2-methylpropyl)-1-(1-phenylethyl)triazole-4-carboxylic acid
CID 82206153
3-[5-methyl-1-(1-phenylethyl)triazol-4-yl]propan-1-ol
CID 82206301
2-[5-methyl-1-(1-phenylethyl)triazol-4-yl]ethanamine
CID 82206303
1-(2,5-dimethylphenyl)-4-(hydroxymethyl)piperidin-4-ol
CID 143566862
(2R)-1-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]propan-2-ol
CID 133499657
[5-(4-fluorophenyl)-1-(1-phenylethyl)triazol-4-yl]methanol
CID 82206224

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol?
The IUPAC name of 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol (CID 95222707) is 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol.
What is the SMILES notation for 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol?
The canonical SMILES for 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol is C[C@H](c1ccccc1)n1nnnc1N1CCC(O)(CO)CC1.
What is the InChIKey of 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol?
The InChIKey is QUCXBQJLXJLZJI-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H21N5O2/c1-12(13-5-3-2-4-6-13)20-14(16-17-18-20)19-9-7-15(22,11-21)8-10-19/h2-6,12,21-22H,7-11H2,1H3/t12-/m1/s1.
What are the key properties of 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol?
4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol has a molecular weight of 303.37 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-1-[1-[(1R)-1-phenylethyl]tetrazol-5-yl]piperidin-4-ol is sourced from PubChem (CID 95222707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).