pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol

C19H22N6O — CID 77082634

IUPACpyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol
SMILESOC(c1ccccn1)C1CCN(Cc2ccc(-c3nn[nH]n3)cc2)CC1
InChIInChI=1S/C19H22N6O/c26-18(17-3-1-2-10-20-17)15-8-11-25(12-9-15)13-14-4-6-16(7-5-14)19-21-23-24-22-19/h1-7,10,15,18,26H,8-9,11-13H2,(H,21,22,23,24)
InChIKeyRQBYVVVMLXSNAB-UHFFFAOYSA-N
MW350.43 g/mol
LogP2.21
Rot. Bonds5

About pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol

pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol (PubChem CID 77082634) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol.

Molecular Properties

Compound Namepyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol
PubChem CID77082634
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC Namepyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol
SMILESOC(c1ccccn1)C1CCN(Cc2ccc(-c3nn[nH]n3)cc2)CC1
InChIInChI=1S/C19H22N6O/c26-18(17-3-1-2-10-20-17)15-8-11-25(12-9-15)13-14-4-6-16(7-5-14)19-21-23-24-22-19/h1-7,10,15,18,26H,8-9,11-13H2,(H,21,22,23,24)
InChIKeyRQBYVVVMLXSNAB-UHFFFAOYSA-N
XLogP2.21
TPSA90.82 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-methyl-1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidine
CID 3244608
(R)-[1-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 99933667
(S)-[1-[(2-cyclohexylpyrimidin-5-yl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 99942839
[1-[(3-ethoxyphenyl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 53193333
[1-[[3-chloro-5-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]-(1H-imidazol-2-yl)methanol
CID 167764311
2-methoxy-N-[[1-[(4-phenylphenyl)methyl]piperidin-4-yl]-pyridin-2-ylmethyl]acetamide
CID 110228631
[1-[[5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl]methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 45210993
(S)-[1-[(4,5-dimethyl-1H-benzimidazol-2-yl)methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 124844163
N-[(S)-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-pyridin-2-ylmethyl]-2-phenylacetamide
CID 92574484
3-[2-[4-[(R)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]ethyl]-1H-imidazol-2-one
CID 124750427
2H-benzotriazol-5-yl-[4-[(R)-hydroxy(pyridin-2-yl)methyl]piperidin-1-yl]methanone
CID 99937481
[1-[[3-(methylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-4-yl]-pyridin-2-ylmethanol
CID 118771614

Frequently Asked Questions

What is the IUPAC name of pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol?
The IUPAC name of pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol (CID 77082634) is pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol.
What is the SMILES notation for pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol?
The canonical SMILES for pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol is OC(c1ccccn1)C1CCN(Cc2ccc(-c3nn[nH]n3)cc2)CC1.
What is the InChIKey of pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol?
The InChIKey is RQBYVVVMLXSNAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O/c26-18(17-3-1-2-10-20-17)15-8-11-25(12-9-15)13-14-4-6-16(7-5-14)19-21-23-24-22-19/h1-7,10,15,18,26H,8-9,11-13H2,(H,21,22,23,24).
What are the key properties of pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol?
pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol has a molecular weight of 350.43 g/mol, XLogP of 2.21, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-2-yl-[1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]piperidin-4-yl]methanol is sourced from PubChem (CID 77082634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).