N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine

C11H20N4S — CID 106642542

IUPACN-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine
SMILESCCCN(CC1CCCCN1)c1ncns1
InChIInChI=1S/C11H20N4S/c1-2-7-15(11-13-9-14-16-11)8-10-5-3-4-6-12-10/h9-10,12H,2-8H2,1H3
InChIKeyNZGMIROPLDRPAU-UHFFFAOYSA-N
MW240.38 g/mol
LogP1.90
Rot. Bonds5

About N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine

N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine (PubChem CID 106642542) has the molecular formula C11H20N4S and a molecular weight of 240.38 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine
PubChem CID106642542
Molecular FormulaC11H20N4S
Molecular Weight240.38 g/mol
Exact Mass240.14
IUPAC NameN-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine
SMILESCCCN(CC1CCCCN1)c1ncns1
InChIInChI=1S/C11H20N4S/c1-2-7-15(11-13-9-14-16-11)8-10-5-3-4-6-12-10/h9-10,12H,2-8H2,1H3
InChIKeyNZGMIROPLDRPAU-UHFFFAOYSA-N
XLogP1.90
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.38
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxyethyl)-N-(pyrrolidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 106621078
N-cyclopropyl-N-(piperidin-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 106641188
5-chloro-N-(piperidin-2-ylmethyl)-N-propylpyrimidin-2-amine
CID 106642347
4,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propylpyrimidin-2-amine
CID 106642566
1-methyl-N-(piperidin-2-ylmethyl)-N-propylimidazol-2-amine
CID 106642484
5-iodo-N-(piperidin-2-ylmethyl)-N-propylpyrimidin-4-amine
CID 106642309
4-[piperidin-2-ylmethyl(propyl)amino]-1H-pyrimidin-6-one
CID 136805325
5,6-dimethyl-N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-triazin-3-amine
CID 106642559
N-(piperidin-2-ylmethyl)-N-(1,3-thiazol-2-ylmethyl)propan-1-amine
CID 106623603
5-[piperidin-2-ylmethyl(propyl)amino]pyridine-2-carbonitrile
CID 106642589
5-bromo-3-methyl-N-(piperidin-2-ylmethyl)-N-propylpyridin-2-amine
CID 106642340
5,6-dimethyl-N-propyl-N-(pyrrolidin-2-ylmethyl)pyrazin-2-amine
CID 106619724

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine?
The IUPAC name of N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine (CID 106642542) is N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine?
The canonical SMILES for N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine is CCCN(CC1CCCCN1)c1ncns1.
What is the InChIKey of N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine?
The InChIKey is NZGMIROPLDRPAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4S/c1-2-7-15(11-13-9-14-16-11)8-10-5-3-4-6-12-10/h9-10,12H,2-8H2,1H3.
What are the key properties of N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine?
N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine has a molecular weight of 240.38 g/mol, XLogP of 1.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-N-propyl-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 106642542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).