1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine

C7H11N3S — CID 130545567

IUPAC1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine
SMILESCc1nnc(C2(N)CCC2)s1
InChIInChI=1S/C7H11N3S/c1-5-9-10-6(11-5)7(8)3-2-4-7/h2-4,8H2,1H3
InChIKeyUKTIDGFNVYDTDF-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.18
Rot. Bonds1

About 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine

1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine (PubChem CID 130545567) has the molecular formula C7H11N3S and a molecular weight of 169.25 g/mol. Its IUPAC name is 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine
PubChem CID130545567
Molecular FormulaC7H11N3S
Molecular Weight169.25 g/mol
Exact Mass169.07
IUPAC Name1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine
SMILESCc1nnc(C2(N)CCC2)s1
InChIInChI=1S/C7H11N3S/c1-5-9-10-6(11-5)7(8)3-2-4-7/h2-4,8H2,1H3
InChIKeyUKTIDGFNVYDTDF-UHFFFAOYSA-N
XLogP1.18
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(Difluoromethyl)-1,3,4-thiadiazol-2-yl]cyclobutan-1-amine
CID 130563645
2-(5-Methyl-1,3,4-thiadiazol-2-yl)propan-2-amine
CID 82467882
2-Cyclobutyl-5-methyl-1,3,4-thiadiazole
CID 117980651
1-(5-Methyl-1,3,4-thiadiazol-2-yl)cyclopropan-1-amine
CID 126980410
2-[1-(5-Methyl-1,3,4-thiadiazol-2-yl)cyclobutyl]guanidine
CID 139573609
1-(5-Tert-butyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine
CID 155794992
(5-Cyclobutyl-1,3,4-thiadiazol-2-yl)methanamine
CID 65725743
1-(5-Cyclobutyl-1,3,4-thiadiazol-2-yl)propan-1-amine
CID 65727912
1-(5-Cyclobutyl-1,3,4-thiadiazol-2-yl)ethanamine
CID 65728692
1-(5-Cyclobutyl-1,3,4-thiadiazol-2-yl)-2-methylpropan-1-amine
CID 83639656
2-(5-Methyl-1,3,4-thiadiazol-2-yl)butan-2-amine
CID 130545468
1-[(5-Methyl-1,3,4-thiadiazol-2-yl)methyl]cyclopropan-1-amine
CID 164653821

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine?
The IUPAC name of 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine (CID 130545567) is 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine.
What is the SMILES notation for 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine?
The canonical SMILES for 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine is Cc1nnc(C2(N)CCC2)s1.
What is the InChIKey of 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine?
The InChIKey is UKTIDGFNVYDTDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3S/c1-5-9-10-6(11-5)7(8)3-2-4-7/h2-4,8H2,1H3.
What are the key properties of 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine?
1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine has a molecular weight of 169.25 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1,3,4-thiadiazol-2-yl)cyclobutan-1-amine is sourced from PubChem (CID 130545567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).