N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine

C11H20N4S — CID 133383292

IUPACN-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine
SMILESCC(C)c1nnc(NC2CCN(C)CC2)s1
InChIInChI=1S/C11H20N4S/c1-8(2)10-13-14-11(16-10)12-9-4-6-15(3)7-5-9/h8-9H,4-7H2,1-3H3,(H,12,14)
InChIKeyRIDVJKHXUWBUMS-UHFFFAOYSA-N
MW240.38 g/mol
LogP2.17
Rot. Bonds3

About N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine

N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine (PubChem CID 133383292) has the molecular formula C11H20N4S and a molecular weight of 240.38 g/mol. Its IUPAC name is N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound NameN-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine
PubChem CID133383292
Molecular FormulaC11H20N4S
Molecular Weight240.38 g/mol
Exact Mass240.14
IUPAC NameN-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine
SMILESCC(C)c1nnc(NC2CCN(C)CC2)s1
InChIInChI=1S/C11H20N4S/c1-8(2)10-13-14-11(16-10)12-9-4-6-15(3)7-5-9/h8-9H,4-7H2,1-3H3,(H,12,14)
InChIKeyRIDVJKHXUWBUMS-UHFFFAOYSA-N
XLogP2.17
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.38
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

propan-2-yl 4-[(5-propan-2-yl-1,3,4-thiadiazol-2-yl)amino]piperidine-1-carboxylate
CID 71913744
5-tert-butyl-N-(1-methylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine
CID 133383350
5-(1-aminoethyl)-N-cyclohexyl-1,3,4-thiadiazol-2-amine
CID 46930853
5-(2-chlorophenyl)-N-(1-methylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine
CID 133467477
N-(2-cyclopropyloxan-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine
CID 133473691
N-[(3R)-1-methylpyrrolidin-3-yl]-5-propan-2-yl-1,3,4-thiadiazole-2-carboxamide
CID 124889052
5-bromo-N-(1-propylpiperidin-4-yl)-1,3,4-thiadiazol-2-amine
CID 64622641
N-(cyclopropylmethyl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine
CID 130685931
2-[(1-methylpiperidin-4-yl)amino]-1,3-thiazole-5-carboxylic acid
CID 80572046
4-bromo-N-(1-methylpiperidin-4-yl)-1,3-thiazol-2-amine
CID 79399978
5-propan-2-yl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,3,4-thiadiazol-2-amine
CID 133366101
N-(1-methylpiperidin-3-yl)-5-(2-methylpropyl)-1,3,4-thiadiazol-2-amine
CID 114165463

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine?
The IUPAC name of N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine (CID 133383292) is N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine?
The canonical SMILES for N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine is CC(C)c1nnc(NC2CCN(C)CC2)s1.
What is the InChIKey of N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine?
The InChIKey is RIDVJKHXUWBUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4S/c1-8(2)10-13-14-11(16-10)12-9-4-6-15(3)7-5-9/h8-9H,4-7H2,1-3H3,(H,12,14).
What are the key properties of N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine?
N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine has a molecular weight of 240.38 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidin-4-yl)-5-propan-2-yl-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 133383292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).