3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine

C10H15N3OS — CID 82729163

IUPAC3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine
SMILESCC1OCCC1Nc1nc(C2CC2)ns1
InChIInChI=1S/C10H15N3OS/c1-6-8(4-5-14-6)11-10-12-9(13-15-10)7-2-3-7/h6-8H,2-5H2,1H3,(H,11,12,13)
InChIKeyUIEBGICSWMWFDM-UHFFFAOYSA-N
MW225.32 g/mol
LogP2.00
Rot. Bonds3

About 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine

3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine (PubChem CID 82729163) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine
PubChem CID82729163
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine
SMILESCC1OCCC1Nc1nc(C2CC2)ns1
InChIInChI=1S/C10H15N3OS/c1-6-8(4-5-14-6)11-10-12-9(13-15-10)7-2-3-7/h6-8H,2-5H2,1H3,(H,11,12,13)
InChIKeyUIEBGICSWMWFDM-UHFFFAOYSA-N
XLogP2.00
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-(cyclopropylmethoxy)propyl]-3-propan-2-yl-1,2,4-thiadiazol-5-amine
CID 72112104
N-(2-methyloxolan-3-yl)-3-(trifluoromethyl)-1,2,4-thiadiazol-5-amine
CID 107305079
3-cyclopropyl-N-[(3R,4S)-4-fluorooxolan-3-yl]-N-methyl-1,2,4-thiadiazol-5-amine
CID 126856253
3-cyclopropyl-N-(4-fluorooxolan-3-yl)-1,2,4-thiadiazol-5-amine
CID 126856331
3-cyclopropyl-N-(2-fluorooxan-3-yl)-1,2,4-thiadiazol-5-amine
CID 126857109
3-methyl-N-(oxan-3-yl)-1,2,4-thiadiazol-5-amine
CID 65267466
3-methyl-N-[2-(oxolan-2-yl)ethyl]-1,2,4-thiadiazol-5-amine
CID 65267511
3-(1-ethoxyethyl)-N-(2-methylpropyl)-1,2,4-thiadiazol-5-amine
CID 65267528
3-methyl-N-(oxolan-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 65267620
N-(2-methoxyethyl)-3-(oxolan-2-ylmethyl)-1,2,4-thiadiazol-5-amine
CID 65267942
3-cyclopropyl-N-(2-methoxyethyl)-1,2,4-thiadiazol-5-amine
CID 65267945
3-methyl-N-[1-(oxolan-2-yl)ethyl]-1,2,4-thiadiazol-5-amine
CID 65268150

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine?
The IUPAC name of 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine (CID 82729163) is 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine.
What is the SMILES notation for 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine?
The canonical SMILES for 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine is CC1OCCC1Nc1nc(C2CC2)ns1.
What is the InChIKey of 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine?
The InChIKey is UIEBGICSWMWFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-6-8(4-5-14-6)11-10-12-9(13-15-10)7-2-3-7/h6-8H,2-5H2,1H3,(H,11,12,13).
What are the key properties of 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine?
3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine has a molecular weight of 225.32 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(2-methyloxolan-3-yl)-1,2,4-thiadiazol-5-amine is sourced from PubChem (CID 82729163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).