N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide

C14H24N4OS — CID 163351135

IUPACN,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide
SMILESCc1nsc(N2CCCC(N(C)C(=O)C(C)(C)C)C2)n1
InChIInChI=1S/C14H24N4OS/c1-10-15-13(20-16-10)18-8-6-7-11(9-18)17(5)12(19)14(2,3)4/h11H,6-9H2,1-5H3
InChIKeyXPGALWVTEIGXCJ-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.32
Rot. Bonds2

About N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide

N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide (PubChem CID 163351135) has the molecular formula C14H24N4OS and a molecular weight of 296.44 g/mol. Its IUPAC name is N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide
PubChem CID163351135
Molecular FormulaC14H24N4OS
Molecular Weight296.44 g/mol
Exact Mass296.17
IUPAC NameN,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide
SMILESCc1nsc(N2CCCC(N(C)C(=O)C(C)(C)C)C2)n1
InChIInChI=1S/C14H24N4OS/c1-10-15-13(20-16-10)18-8-6-7-11(9-18)17(5)12(19)14(2,3)4/h11H,6-9H2,1-5H3
InChIKeyXPGALWVTEIGXCJ-UHFFFAOYSA-N
XLogP2.32
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide?
The IUPAC name of N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide (CID 163351135) is N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide.
What is the SMILES notation for N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide?
The canonical SMILES for N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide is Cc1nsc(N2CCCC(N(C)C(=O)C(C)(C)C)C2)n1.
What is the InChIKey of N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide?
The InChIKey is XPGALWVTEIGXCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4OS/c1-10-15-13(20-16-10)18-8-6-7-11(9-18)17(5)12(19)14(2,3)4/h11H,6-9H2,1-5H3.
What are the key properties of N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide?
N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide has a molecular weight of 296.44 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-N-[1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-3-yl]propanamide is sourced from PubChem (CID 163351135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).