piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate

C15H17N3O2S — CID 66810730

IUPACpiperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate
SMILESO=C(Nc1ccccc1-c1nccs1)OC1CCNCC1
InChIInChI=1S/C15H17N3O2S/c19-15(20-11-5-7-16-8-6-11)18-13-4-2-1-3-12(13)14-17-9-10-21-14/h1-4,9-11,16H,5-8H2,(H,18,19)
InChIKeyUDYWYWXODFDXLB-UHFFFAOYSA-N
MW303.39 g/mol
LogP3.11
Rot. Bonds3

About piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate

piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate (PubChem CID 66810730) has the molecular formula C15H17N3O2S and a molecular weight of 303.39 g/mol. Its IUPAC name is piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate.

Molecular Properties

Compound Namepiperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate
PubChem CID66810730
Molecular FormulaC15H17N3O2S
Molecular Weight303.39 g/mol
Exact Mass303.10
IUPAC Namepiperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate
SMILESO=C(Nc1ccccc1-c1nccs1)OC1CCNCC1
InChIInChI=1S/C15H17N3O2S/c19-15(20-11-5-7-16-8-6-11)18-13-4-2-1-3-12(13)14-17-9-10-21-14/h1-4,9-11,16H,5-8H2,(H,18,19)
InChIKeyUDYWYWXODFDXLB-UHFFFAOYSA-N
XLogP3.11
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate?
The IUPAC name of piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate (CID 66810730) is piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate.
What is the SMILES notation for piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate?
The canonical SMILES for piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate is O=C(Nc1ccccc1-c1nccs1)OC1CCNCC1.
What is the InChIKey of piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate?
The InChIKey is UDYWYWXODFDXLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2S/c19-15(20-11-5-7-16-8-6-11)18-13-4-2-1-3-12(13)14-17-9-10-21-14/h1-4,9-11,16H,5-8H2,(H,18,19).
What are the key properties of piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate?
piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate has a molecular weight of 303.39 g/mol, XLogP of 3.11, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-4-yl N-[2-(1,3-thiazol-2-yl)phenyl]carbamate is sourced from PubChem (CID 66810730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).