[2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone

C19H18FN5O — CID 71946734

IUPAC[2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1cc(-n2cnnn2)ccc1F)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C19H18FN5O/c20-18-7-6-16(25-13-21-22-23-25)12-17(18)19(26)24-10-8-15(9-11-24)14-4-2-1-3-5-14/h1-7,12-13,15H,8-11H2
InChIKeyODWODJHAPXRCEI-UHFFFAOYSA-N
MW351.39 g/mol
LogP2.82
Rot. Bonds3

About [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone

[2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone (PubChem CID 71946734) has the molecular formula C19H18FN5O and a molecular weight of 351.39 g/mol. Its IUPAC name is [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone
PubChem CID71946734
Molecular FormulaC19H18FN5O
Molecular Weight351.39 g/mol
Exact Mass351.15
IUPAC Name[2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone
SMILESO=C(c1cc(-n2cnnn2)ccc1F)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C19H18FN5O/c20-18-7-6-16(25-13-21-22-23-25)12-17(18)19(26)24-10-8-15(9-11-24)14-4-2-1-3-5-14/h1-7,12-13,15H,8-11H2
InChIKeyODWODJHAPXRCEI-UHFFFAOYSA-N
XLogP2.82
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.39
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-2-(4-phenylpiperidine-1-carbonyl)benzamide
CID 68831202
(7-phenyl-1,4-thiazepan-4-yl)-[3-(tetrazol-1-yl)phenyl]methanone
CID 90629300
[4-chloro-2-(tetrazol-1-yl)phenyl]-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone
CID 71705867
2-methyl-4-phenyl-5-[1-[3-(tetrazol-1-yl)benzoyl]piperidin-4-yl]-1,2,4-triazol-3-one
CID 90540322
(3-fluoro-4-hydroxyphenyl)-(4-phenylpiperidin-1-yl)methanone
CID 146427603
[3,5-bis(trifluoromethyl)phenyl]-(4-phenylpiperidin-1-yl)methanone
CID 44765726
[5-fluoro-2-(tetrazol-1-yl)phenyl]-[4-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]methanone
CID 71705753
2-hydroxy-5-(tetrazol-1-yl)benzoic acid
CID 3136529
[7-(2-fluorophenyl)-1,1-dioxo-1,4-thiazepan-4-yl]-[3-(tetrazol-1-yl)phenyl]methanone
CID 121192226
1-[5-chloro-2-(tetrazol-1-yl)benzoyl]piperidine-4-carboxamide
CID 39896622
[2-chloro-5-(tetrazol-1-yl)phenyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 42534769
[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-[4-(tetrazol-1-yl)phenyl]methanone
CID 21007916

Frequently Asked Questions

What is the IUPAC name of [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone?
The IUPAC name of [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone (CID 71946734) is [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone.
What is the SMILES notation for [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone?
The canonical SMILES for [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone is O=C(c1cc(-n2cnnn2)ccc1F)N1CCC(c2ccccc2)CC1.
What is the InChIKey of [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone?
The InChIKey is ODWODJHAPXRCEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN5O/c20-18-7-6-16(25-13-21-22-23-25)12-17(18)19(26)24-10-8-15(9-11-24)14-4-2-1-3-5-14/h1-7,12-13,15H,8-11H2.
What are the key properties of [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone?
[2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone has a molecular weight of 351.39 g/mol, XLogP of 2.82, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-5-(tetrazol-1-yl)phenyl]-(4-phenylpiperidin-1-yl)methanone is sourced from PubChem (CID 71946734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).