N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine

C10H10N4S — CID 15147975

IUPACN-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
SMILESC=CCNc1nnc(-c2ccccn2)s1
InChIInChI=1S/C10H10N4S/c1-2-6-12-10-14-13-9(15-10)8-5-3-4-7-11-8/h2-5,7H,1,6H2,(H,12,14)
InChIKeyRUVOGSNRSFNCQS-UHFFFAOYSA-N
MW218.28 g/mol
LogP2.20
Rot. Bonds4

About N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine

N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine (PubChem CID 15147975) has the molecular formula C10H10N4S and a molecular weight of 218.28 g/mol. Its IUPAC name is N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine.

Molecular Properties

Compound NameN-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
PubChem CID15147975
Molecular FormulaC10H10N4S
Molecular Weight218.28 g/mol
Exact Mass218.06
IUPAC NameN-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine
SMILESC=CCNc1nnc(-c2ccccn2)s1
InChIInChI=1S/C10H10N4S/c1-2-6-12-10-14-13-9(15-10)8-5-3-4-7-11-8/h2-5,7H,1,6H2,(H,12,14)
InChIKeyRUVOGSNRSFNCQS-UHFFFAOYSA-N
XLogP2.20
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.28
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Pyridine, 3-(5-amino-1,3,4-thiadiazol-2-yl)-
CID 199035
N-methyl-5-pyridin-4-yl-1,3,4-thiadiazol-2-amine
CID 649971
Acetamide, N-(5-(4-pyridyl)-1,3,4-thiadiazol-2-yl)-
CID 19289
1-phenyl-3-[(2E)-5-(pyridin-4-yl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
CID 800218
N-phenyl-5-pyridin-3-yl-1,3,4-thiadiazol-2-amine
CID 946930
Allyl-(5-pyridin-4-yl-[1,3,4]thiadiazol-2-yl)-amine
CID 1933398
N-Methyl-N-(5-pyridin-2-yl-[1,3,4]thiadiazol-2-yl)-acetamide
CID 1446983
5-(pyridin-2-yl)-4-{[(E)-thiophen-2-ylmethylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
CID 6879227
2-(4-Piperidin-1-ylpiperidin-1-yl)-5-pyridin-2-yl-1,3,4-thiadiazole
CID 53317858
1,3,4-Thiadiazol-2-amine, N-phenyl-5-(4-pyridinyl)-
CID 840345
2-Ethylamino-5-(4-pyridyl)-1,3,4-thiadiazole
CID 776566
N-[5-(4-pyridinyl)-1,3,4-thiadiazol-2-yl]propanamide
CID 1247371

Frequently Asked Questions

What is the IUPAC name of N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine?
The IUPAC name of N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine (CID 15147975) is N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine.
What is the SMILES notation for N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine?
The canonical SMILES for N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine is C=CCNc1nnc(-c2ccccn2)s1.
What is the InChIKey of N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine?
The InChIKey is RUVOGSNRSFNCQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4S/c1-2-6-12-10-14-13-9(15-10)8-5-3-4-7-11-8/h2-5,7H,1,6H2,(H,12,14).
What are the key properties of N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine?
N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine has a molecular weight of 218.28 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-amine is sourced from PubChem (CID 15147975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).