N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine

C10H12N4S — CID 134474559

IUPACN-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine
SMILESCCN(c1ccccn1)c1nnc(C)s1
InChIInChI=1S/C10H12N4S/c1-3-14(9-6-4-5-7-11-9)10-13-12-8(2)15-10/h4-7H,3H2,1-2H3
InChIKeyNHHKTYNVDYCRLA-UHFFFAOYSA-N
MW220.30 g/mol
LogP2.40
Rot. Bonds3

About N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine

N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine (PubChem CID 134474559) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine
PubChem CID134474559
Molecular FormulaC10H12N4S
Molecular Weight220.30 g/mol
Exact Mass220.08
IUPAC NameN-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine
SMILESCCN(c1ccccn1)c1nnc(C)s1
InChIInChI=1S/C10H12N4S/c1-3-14(9-6-4-5-7-11-9)10-13-12-8(2)15-10/h4-7H,3H2,1-2H3
InChIKeyNHHKTYNVDYCRLA-UHFFFAOYSA-N
XLogP2.40
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine?
The IUPAC name of N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine (CID 134474559) is N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine?
The canonical SMILES for N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine is CCN(c1ccccn1)c1nnc(C)s1.
What is the InChIKey of N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine?
The InChIKey is NHHKTYNVDYCRLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4S/c1-3-14(9-6-4-5-7-11-9)10-13-12-8(2)15-10/h4-7H,3H2,1-2H3.
What are the key properties of N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine?
N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine has a molecular weight of 220.30 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-methyl-N-pyridin-2-yl-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 134474559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).