5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine

C13H17N5S — CID 82452399

IUPAC5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine
SMILESCCN1CCc2nc(C)c(-c3nnc(N)s3)cc2C1
InChIInChI=1S/C13H17N5S/c1-3-18-5-4-11-9(7-18)6-10(8(2)15-11)12-16-17-13(14)19-12/h6H,3-5,7H2,1-2H3,(H2,14,17)
InChIKeyFTSWKUXKQDRESZ-UHFFFAOYSA-N
MW275.38 g/mol
LogP1.87
Rot. Bonds2

About 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine

5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine (PubChem CID 82452399) has the molecular formula C13H17N5S and a molecular weight of 275.38 g/mol. Its IUPAC name is 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound Name5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine
PubChem CID82452399
Molecular FormulaC13H17N5S
Molecular Weight275.38 g/mol
Exact Mass275.12
IUPAC Name5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine
SMILESCCN1CCc2nc(C)c(-c3nnc(N)s3)cc2C1
InChIInChI=1S/C13H17N5S/c1-3-18-5-4-11-9(7-18)6-10(8(2)15-11)12-16-17-13(14)19-12/h6H,3-5,7H2,1-2H3,(H2,14,17)
InChIKeyFTSWKUXKQDRESZ-UHFFFAOYSA-N
XLogP1.87
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)propan-2-amine
CID 82452395
1-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-N-methylmethanamine
CID 82452375
5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-3H-1,3,4-oxadiazole-2-thione
CID 82452409
N-[(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)methyl]propan-2-amine
CID 82452377
(2,6-diethyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)hydrazine;ethane
CID 172587653
N-methyl-5-(2-methyl-5,6,7,8-tetrahydroquinolin-3-yl)-1,3,4-thiadiazol-2-amine
CID 82452304
6-ethyl-7,8-dihydro-5H-1,6-naphthyridin-3-ol
CID 119030367
2-chloro-6-ethyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 127011894
7-ethyl-2-methyl-3-nitro-5,6,8,9-tetrahydropyrido[2,3-d]azepine
CID 130246399
6-ethyl-15-hydroxy-17-thia-2,6,12-triazatetracyclo[8.7.0.03,8.011,16]heptadeca-1(10),2,8,11(16),14-pentaen-13-one
CID 54682898
5-[2-[(4-ethylpiperazin-1-yl)methyl]-1,3-thiazol-5-yl]-1,3,4-thiadiazol-2-amine
CID 82424866
5-ethyl-4,6,7,8-tetrahydrothieno[3,2-c]azepin-2-amine
CID 13277390

Frequently Asked Questions

What is the IUPAC name of 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine?
The IUPAC name of 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine (CID 82452399) is 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine?
The canonical SMILES for 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine is CCN1CCc2nc(C)c(-c3nnc(N)s3)cc2C1.
What is the InChIKey of 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine?
The InChIKey is FTSWKUXKQDRESZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5S/c1-3-18-5-4-11-9(7-18)6-10(8(2)15-11)12-16-17-13(14)19-12/h6H,3-5,7H2,1-2H3,(H2,14,17).
What are the key properties of 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine?
5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine has a molecular weight of 275.38 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-ethyl-2-methyl-7,8-dihydro-5H-1,6-naphthyridin-3-yl)-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 82452399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).