[6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine

C10H18N4S — CID 65208327

IUPAC[6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine
SMILESCc1nnc(N2C(C)CCCC2CN)s1
InChIInChI=1S/C10H18N4S/c1-7-4-3-5-9(6-11)14(7)10-13-12-8(2)15-10/h7,9H,3-6,11H2,1-2H3
InChIKeyWCOFMKWVMZPTJR-UHFFFAOYSA-N
MW226.35 g/mol
LogP1.55
Rot. Bonds2

About [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine

[6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine (PubChem CID 65208327) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine.

Molecular Properties

Compound Name[6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine
PubChem CID65208327
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC Name[6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine
SMILESCc1nnc(N2C(C)CCCC2CN)s1
InChIInChI=1S/C10H18N4S/c1-7-4-3-5-9(6-11)14(7)10-13-12-8(2)15-10/h7,9H,3-6,11H2,1-2H3
InChIKeyWCOFMKWVMZPTJR-UHFFFAOYSA-N
XLogP1.55
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine?
The IUPAC name of [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine (CID 65208327) is [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine.
What is the SMILES notation for [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine?
The canonical SMILES for [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine is Cc1nnc(N2C(C)CCCC2CN)s1.
What is the InChIKey of [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine?
The InChIKey is WCOFMKWVMZPTJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-7-4-3-5-9(6-11)14(7)10-13-12-8(2)15-10/h7,9H,3-6,11H2,1-2H3.
What are the key properties of [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine?
[6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine has a molecular weight of 226.35 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-2-yl]methanamine is sourced from PubChem (CID 65208327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).