1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol

C15H21N5O — CID 124621931

IUPAC1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol
SMILESC[C@@H](c1nnnn1C)N1CCC(O)(c2ccccc2)CC1
InChIInChI=1S/C15H21N5O/c1-12(14-16-17-18-19(14)2)20-10-8-15(21,9-11-20)13-6-4-3-5-7-13/h3-7,12,21H,8-11H2,1-2H3/t12-/m0/s1
InChIKeyRKGRIGAREFZCON-LBPRGKRZSA-N
MW287.37 g/mol
LogP1.25
Rot. Bonds3

About 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol

1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol (PubChem CID 124621931) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol.

Molecular Properties

Compound Name1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol
PubChem CID124621931
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol
SMILESC[C@@H](c1nnnn1C)N1CCC(O)(c2ccccc2)CC1
InChIInChI=1S/C15H21N5O/c1-12(14-16-17-18-19(14)2)20-10-8-15(21,9-11-20)13-6-4-3-5-7-13/h3-7,12,21H,8-11H2,1-2H3/t12-/m0/s1
InChIKeyRKGRIGAREFZCON-LBPRGKRZSA-N
XLogP1.25
TPSA67.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1'-[1-(1-methyltetrazol-5-yl)ethyl]spiro[3,4-dihydrochromene-2,4'-piperidine]
CID 154842458
1-(1-methyltetrazol-5-yl)-4-(4-phenylphenyl)piperidin-4-ol
CID 146128341
1-[1-[amino(methyl)amino]ethyl]-4-phenylpiperidin-4-ol
CID 57010939
1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-3-[(1R)-1-(1-phenylcyclopentyl)ethyl]urea
CID 100703457
3-phenyl-1-propan-2-ylazetidin-3-ol
CID 58547253
1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-[4-(trifluoromethyl)phenyl]piperazine
CID 99828945
3-phenyl-1-propan-2-ylpiperidin-3-ol
CID 12689966
(1R)-1-(1-methyltetrazol-5-yl)ethanol
CID 93497611
4-[(2-methoxyphenyl)methoxy]-1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]piperidine
CID 124621758
(2S)-2-(4-hydroxy-4-phenylpiperidin-1-yl)-1-[4-tri(propan-2-yl)silyloxyphenyl]propan-1-one
CID 10457934
8-chloro-2-[1-(1-methyltetrazol-5-yl)ethyl]-3,4-dihydro-1H-isoquinoline
CID 139013594
1-[(1S,2S)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]-3-phenylpyrrolidin-3-ol
CID 70057699

Frequently Asked Questions

What is the IUPAC name of 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol?
The IUPAC name of 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol (CID 124621931) is 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol.
What is the SMILES notation for 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol?
The canonical SMILES for 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol is C[C@@H](c1nnnn1C)N1CCC(O)(c2ccccc2)CC1.
What is the InChIKey of 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol?
The InChIKey is RKGRIGAREFZCON-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H21N5O/c1-12(14-16-17-18-19(14)2)20-10-8-15(21,9-11-20)13-6-4-3-5-7-13/h3-7,12,21H,8-11H2,1-2H3/t12-/m0/s1.
What are the key properties of 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol?
1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol has a molecular weight of 287.37 g/mol, XLogP of 1.25, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1S)-1-(1-methyltetrazol-5-yl)ethyl]-4-phenylpiperidin-4-ol is sourced from PubChem (CID 124621931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).