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

C10H18N4S — CID 71132619

IUPACN,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine
SMILESCc1nsc(N2CCC(N(C)C)CC2)n1
InChIInChI=1S/C10H18N4S/c1-8-11-10(15-12-8)14-6-4-9(5-7-14)13(2)3/h9H,4-7H2,1-3H3
InChIKeyLJYYAKSWISRTHF-UHFFFAOYSA-N
MW226.35 g/mol
LogP1.38
Rot. Bonds2

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

N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine (PubChem CID 71132619) has the molecular formula C10H18N4S and a molecular weight of 226.35 g/mol. Its IUPAC name is N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine.

Molecular Properties

Compound NameN,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine
PubChem CID71132619
Molecular FormulaC10H18N4S
Molecular Weight226.35 g/mol
Exact Mass226.13
IUPAC NameN,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine
SMILESCc1nsc(N2CCC(N(C)C)CC2)n1
InChIInChI=1S/C10H18N4S/c1-8-11-10(15-12-8)14-6-4-9(5-7-14)13(2)3/h9H,4-7H2,1-3H3
InChIKeyLJYYAKSWISRTHF-UHFFFAOYSA-N
XLogP1.38
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.35
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine?
The IUPAC name of N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine (CID 71132619) is N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine.
What is the SMILES notation for N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine?
The canonical SMILES for N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine is Cc1nsc(N2CCC(N(C)C)CC2)n1.
What is the InChIKey of N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine?
The InChIKey is LJYYAKSWISRTHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4S/c1-8-11-10(15-12-8)14-6-4-9(5-7-14)13(2)3/h9H,4-7H2,1-3H3.
What are the key properties of N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine?
N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine has a molecular weight of 226.35 g/mol, XLogP of 1.38, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(3-methyl-1,2,4-thiadiazol-5-yl)piperidin-4-amine is sourced from PubChem (CID 71132619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).