2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole

C15H17N7OS — CID 66911033

IUPAC2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole
SMILESc1cc(-c2nn[nH]n2)ncc1OCc1csc(C2CCNCC2)n1
InChIInChI=1S/C15H17N7OS/c1-2-13(14-19-21-22-20-14)17-7-12(1)23-8-11-9-24-15(18-11)10-3-5-16-6-4-10/h1-2,7,9-10,16H,3-6,8H2,(H,19,20,21,22)
InChIKeyNNYYCOULDWDCAC-UHFFFAOYSA-N
MW343.42 g/mol
LogP1.76
Rot. Bonds5

About 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole

2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole (PubChem CID 66911033) has the molecular formula C15H17N7OS and a molecular weight of 343.42 g/mol. Its IUPAC name is 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole.

Molecular Properties

Compound Name2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole
PubChem CID66911033
Molecular FormulaC15H17N7OS
Molecular Weight343.42 g/mol
Exact Mass343.12
IUPAC Name2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole
SMILESc1cc(-c2nn[nH]n2)ncc1OCc1csc(C2CCNCC2)n1
InChIInChI=1S/C15H17N7OS/c1-2-13(14-19-21-22-20-14)17-7-12(1)23-8-11-9-24-15(18-11)10-3-5-16-6-4-10/h1-2,7,9-10,16H,3-6,8H2,(H,19,20,21,22)
InChIKeyNNYYCOULDWDCAC-UHFFFAOYSA-N
XLogP1.76
TPSA101.50 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.42
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2-piperidin-4-yl-1,3-thiazol-4-yl)methanamine
CID 82670559
4-[(3-methyl-4-methylsulfonylphenoxy)methyl]-2-piperidin-4-yl-1,3-thiazole
CID 71081703
4-(ethoxymethyl)-2-piperidin-4-yl-1,3-thiazole;hydrochloride
CID 120558226
N-amino-N-[4-[(2-pyrrolidin-3-yl-1,3-thiazol-4-yl)methoxy]phenyl]methanimidamide
CID 143718393
4-[(2-fluoro-4-methylsulfanylphenoxy)methyl]-2-piperidin-4-yl-1,3-thiazole
CID 134241368
2-[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]-4-[[4-(tetrazol-1-yl)phenoxy]methyl]-1,3-thiazole;hydrobromide
CID 51347381
4-[4-(2H-tetrazol-5-yl)phenyl]piperidine
CID 84792848
2-piperidin-4-yl-4-(pyrrolidin-1-ylmethyl)-1,3-thiazole
CID 82278133
2-(2-pyrrolidin-3-yl-1,3-thiazol-4-yl)ethanamine
CID 115087742
2-[1-(3,3-dimethylbutyl)piperidin-4-yl]-4-[[4-(tetrazol-1-yl)phenoxy]methyl]-1,3-thiazole
CID 154460364
2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]-4-[[6-(triazol-1-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole
CID 129040762
4-(2-phenylpyrimidin-5-yl)-2-piperidin-4-yl-1,3-thiazole
CID 59252377

Frequently Asked Questions

What is the IUPAC name of 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole?
The IUPAC name of 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole (CID 66911033) is 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole.
What is the SMILES notation for 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole?
The canonical SMILES for 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole is c1cc(-c2nn[nH]n2)ncc1OCc1csc(C2CCNCC2)n1.
What is the InChIKey of 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole?
The InChIKey is NNYYCOULDWDCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N7OS/c1-2-13(14-19-21-22-20-14)17-7-12(1)23-8-11-9-24-15(18-11)10-3-5-16-6-4-10/h1-2,7,9-10,16H,3-6,8H2,(H,19,20,21,22).
What are the key properties of 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole?
2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole has a molecular weight of 343.42 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-yl-4-[[6-(2H-tetrazol-5-yl)-3-pyridinyl]oxymethyl]-1,3-thiazole is sourced from PubChem (CID 66911033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).