N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine

C10H12N4S — CID 105160535

IUPACN-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine
SMILESCNC(Cc1ccncc1)c1csnn1
InChIInChI=1S/C10H12N4S/c1-11-9(10-7-15-14-13-10)6-8-2-4-12-5-3-8/h2-5,7,9,11H,6H2,1H3
InChIKeyHMTRCTLJPQLYIU-UHFFFAOYSA-N
MW220.30 g/mol
LogP1.44
Rot. Bonds4

About N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine

N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine (PubChem CID 105160535) has the molecular formula C10H12N4S and a molecular weight of 220.30 g/mol. Its IUPAC name is N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine
PubChem CID105160535
Molecular FormulaC10H12N4S
Molecular Weight220.30 g/mol
Exact Mass220.08
IUPAC NameN-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine
SMILESCNC(Cc1ccncc1)c1csnn1
InChIInChI=1S/C10H12N4S/c1-11-9(10-7-15-14-13-10)6-8-2-4-12-5-3-8/h2-5,7,9,11H,6H2,1H3
InChIKeyHMTRCTLJPQLYIU-UHFFFAOYSA-N
XLogP1.44
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine?
The IUPAC name of N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine (CID 105160535) is N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine.
What is the SMILES notation for N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine?
The canonical SMILES for N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine is CNC(Cc1ccncc1)c1csnn1.
What is the InChIKey of N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine?
The InChIKey is HMTRCTLJPQLYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4S/c1-11-9(10-7-15-14-13-10)6-8-2-4-12-5-3-8/h2-5,7,9,11H,6H2,1H3.
What are the key properties of N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine?
N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine has a molecular weight of 220.30 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-pyridin-4-yl-1-(thiadiazol-4-yl)ethanamine is sourced from PubChem (CID 105160535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).