N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine

C11H14N4S2 — CID 55076591

IUPACN-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine
SMILESCCCNc1ncccc1CSc1nncs1
InChIInChI=1S/C11H14N4S2/c1-2-5-12-10-9(4-3-6-13-10)7-16-11-15-14-8-17-11/h3-4,6,8H,2,5,7H2,1H3,(H,12,13)
InChIKeyNRFCMHXYTHWXFD-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.05
Rot. Bonds6

About N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine

N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine (PubChem CID 55076591) has the molecular formula C11H14N4S2 and a molecular weight of 266.39 g/mol. Its IUPAC name is N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine.

Molecular Properties

Compound NameN-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine
PubChem CID55076591
Molecular FormulaC11H14N4S2
Molecular Weight266.39 g/mol
Exact Mass266.07
IUPAC NameN-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine
SMILESCCCNc1ncccc1CSc1nncs1
InChIInChI=1S/C11H14N4S2/c1-2-5-12-10-9(4-3-6-13-10)7-16-11-15-14-8-17-11/h3-4,6,8H,2,5,7H2,1H3,(H,12,13)
InChIKeyNRFCMHXYTHWXFD-UHFFFAOYSA-N
XLogP3.05
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2-methylphenyl)sulfanylmethyl]-N-propylpyridin-2-amine
CID 62468389
3-[(2,4-difluorophenyl)sulfanylmethyl]-N-propylpyridin-2-amine
CID 62468384
3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridine-2-carboxylic acid
CID 63099626
3-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-propylpyridin-2-amine
CID 62467130
3-[[2-(propylamino)-3-pyridinyl]methylsulfanyl]propane-1,2-diol
CID 79671550
N-propyl-4-(1,3,4-thiadiazol-2-ylsulfanylmethyl)thiadiazol-5-amine
CID 62188064
N-methyl-2-[[2-(propylamino)-3-pyridinyl]methylsulfanyl]acetamide
CID 114231922
5-chloro-N-propyl-6-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine
CID 55127461
2-(1,3,4-thiadiazol-2-ylsulfanyl)-N-[2-[[3-(trifluoromethyl)-2-pyridinyl]amino]ethyl]acetamide
CID 51122393
N-methyl-3-(1,3-thiazol-2-ylsulfanylmethyl)pyridin-2-amine
CID 62468212
N-methyl-5-[2-[2-(propylamino)-3-pyridinyl]ethyl]-1,3-thiazol-2-amine
CID 79774349
3-[(2-chlorophenyl)methoxymethyl]-N-propylpyridin-2-amine
CID 62465145

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine?
The IUPAC name of N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine (CID 55076591) is N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine.
What is the SMILES notation for N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine?
The canonical SMILES for N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine is CCCNc1ncccc1CSc1nncs1.
What is the InChIKey of N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine?
The InChIKey is NRFCMHXYTHWXFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4S2/c1-2-5-12-10-9(4-3-6-13-10)7-16-11-15-14-8-17-11/h3-4,6,8H,2,5,7H2,1H3,(H,12,13).
What are the key properties of N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine?
N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine has a molecular weight of 266.39 g/mol, XLogP of 3.05, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-(1,3,4-thiadiazol-2-ylsulfanylmethyl)pyridin-2-amine is sourced from PubChem (CID 55076591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).