3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine

C11H20N4S — CID 65267689

IUPAC3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
SMILESCCCN1CCC(Nc2nc(C)ns2)CC1
InChIInChI=1S/C11H20N4S/c1-3-6-15-7-4-10(5-8-15)13-11-12-9(2)14-16-11/h10H,3-8H2,1-2H3,(H,12,13,14)
InChIKeyFIZNVPRHVAXBGS-UHFFFAOYSA-N
MW240.38 g/mol
LogP2.13
Rot. Bonds4

About 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine

3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine (PubChem CID 65267689) has the molecular formula C11H20N4S and a molecular weight of 240.38 g/mol. Its IUPAC name is 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
PubChem CID65267689
Molecular FormulaC11H20N4S
Molecular Weight240.38 g/mol
Exact Mass240.14
IUPAC Name3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
SMILESCCCN1CCC(Nc2nc(C)ns2)CC1
InChIInChI=1S/C11H20N4S/c1-3-6-15-7-4-10(5-8-15)13-11-12-9(2)14-16-11/h10H,3-8H2,1-2H3,(H,12,13,14)
InChIKeyFIZNVPRHVAXBGS-UHFFFAOYSA-N
XLogP2.13
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.38
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-tert-butylpiperidin-4-yl)-3-methyl-1,2,4-thiadiazol-5-amine
CID 133319574
5-bromo-N-(1-propylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine
CID 64622641
4-ethoxy-5-N-(1-propylpiperidin-4-yl)-1,2-thiazole-3,5-diamine
CID 103360114
N-[(3R)-1-cyclopentylpyrrolidin-3-yl]-3-methyl-1,2,4-thiadiazol-5-amine
CID 97074415
N-[2-(azetidin-1-yl)ethyl]-3-methyl-1,2,4-thiadiazol-5-amine
CID 130743944
N-[1-(2-methylsulfonylethyl)piperidin-4-yl]-3-phenyl-1,2,4-thiadiazol-5-amine
CID 133321526
N-(2,5-dimethylpyrrol-1-yl)-1-propylpiperidin-4-amine
CID 79090139
3-(methoxymethyl)-N-(1-methylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine
CID 133383314
6-hydrazinyl-N-(1-propylpiperidin-4-yl)pyridin-2-amine
CID 80897058
N-(4-bromo-3,5-dimethylphenyl)-1-propylpiperidin-4-amine
CID 107572074
5-iodo-N-(1-propylpiperidin-4-yl)pyrimidin-2-amine
CID 113459447
1-propyl-N-thiophen-3-ylpiperidin-4-amine
CID 66352075

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine (CID 65267689) is 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine is CCCN1CCC(Nc2nc(C)ns2)CC1.
What is the InChIKey of 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine?
The InChIKey is FIZNVPRHVAXBGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4S/c1-3-6-15-7-4-10(5-8-15)13-11-12-9(2)14-16-11/h10H,3-8H2,1-2H3,(H,12,13,14).
What are the key properties of 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine?
3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine has a molecular weight of 240.38 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(1-propylpiperidin-4-yl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 65267689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).