[1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine

C7H11N3S — CID 82412691

IUPAC[1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine
SMILESCc1nnsc1C1(CN)CC1
InChIInChI=1S/C7H11N3S/c1-5-6(11-10-9-5)7(4-8)2-3-7/h2-4,8H2,1H3
InChIKeyICEZHNILDUUVBE-UHFFFAOYSA-N
MW169.25 g/mol
LogP0.84
Rot. Bonds2

About [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine

[1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine (PubChem CID 82412691) has the molecular formula C7H11N3S and a molecular weight of 169.25 g/mol. Its IUPAC name is [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine
PubChem CID82412691
Molecular FormulaC7H11N3S
Molecular Weight169.25 g/mol
Exact Mass169.07
IUPAC Name[1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine
SMILESCc1nnsc1C1(CN)CC1
InChIInChI=1S/C7H11N3S/c1-5-6(11-10-9-5)7(4-8)2-3-7/h2-4,8H2,1H3
InChIKeyICEZHNILDUUVBE-UHFFFAOYSA-N
XLogP0.84
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(4-methyl-2-propyl-1,3-thiazol-5-yl)cyclopropyl]methanamine
CID 116886887
5-[1-(aminomethyl)cyclopropyl]-N,N,4-trimethyl-1,3-thiazol-2-amine
CID 131304128
[1-(thiatriazol-5-yl)cyclopropyl]methanamine
CID 116985771
[3-methyl-1-[(4-methylthiadiazol-5-yl)methyl]cyclobutyl]methanamine
CID 164652955
[1-(4,5-dimethyl-1,3-thiazol-2-yl)cyclopropyl]methanamine
CID 82407544
[1-(2-cyclobutyl-4-methyl-1,3-thiazol-5-yl)cyclopropyl]methanamine
CID 116886917
[1-(5-methyl-2H-triazol-4-yl)cyclopropyl]methanamine
CID 96635679
[1-(5-methylpyridazin-3-yl)cyclopropyl]methanamine
CID 130544936
[1-(1-methylpyrazol-4-yl)cyclopropyl]methanamine
CID 82594919
[1-(2,3,4-trimethylphenyl)cyclopropyl]methanamine
CID 116963513
[1-(2-ethyltetrazol-5-yl)cyclopropyl]methanamine
CID 84765252
2-[1-(3-methyl-1,2,4-thiadiazol-5-yl)cyclopropyl]ethanamine
CID 82406956

Frequently Asked Questions

What is the IUPAC name of [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine?
The IUPAC name of [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine (CID 82412691) is [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine?
The canonical SMILES for [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine is Cc1nnsc1C1(CN)CC1.
What is the InChIKey of [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine?
The InChIKey is ICEZHNILDUUVBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3S/c1-5-6(11-10-9-5)7(4-8)2-3-7/h2-4,8H2,1H3.
What are the key properties of [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine?
[1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine has a molecular weight of 169.25 g/mol, XLogP of 0.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methylthiadiazol-5-yl)cyclopropyl]methanamine is sourced from PubChem (CID 82412691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).