1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine

C10H17N3S2 — CID 104755990

IUPAC1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine
SMILESCc1nsc(SCC(N)C2CCCC2)n1
InChIInChI=1S/C10H17N3S2/c1-7-12-10(15-13-7)14-6-9(11)8-4-2-3-5-8/h8-9H,2-6,11H2,1H3
InChIKeyFUCMBBJQWRDJDD-UHFFFAOYSA-N
MW243.40 g/mol
LogP2.46
Rot. Bonds4

About 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine

1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine (PubChem CID 104755990) has the molecular formula C10H17N3S2 and a molecular weight of 243.40 g/mol. Its IUPAC name is 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine
PubChem CID104755990
Molecular FormulaC10H17N3S2
Molecular Weight243.40 g/mol
Exact Mass243.09
IUPAC Name1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine
SMILESCc1nsc(SCC(N)C2CCCC2)n1
InChIInChI=1S/C10H17N3S2/c1-7-12-10(15-13-7)14-6-9(11)8-4-2-3-5-8/h8-9H,2-6,11H2,1H3
InChIKeyFUCMBBJQWRDJDD-UHFFFAOYSA-N
XLogP2.46
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.40
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-cyclopentyl-2-[(3-ethyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine
CID 104755981
1-cyclohexyl-2-(1,3,4-thiadiazol-2-ylsulfanyl)ethanamine
CID 104755410
1-cyclopropyl-2-(3-methyl-1,2,4-thiadiazol-5-yl)ethanamine
CID 65273347
1-cyclopentyl-2-(4-methylphenyl)sulfanylethanamine
CID 66064798
1-cyclohexyl-2-(5-methylpyrimidin-2-yl)sulfanylethanamine
CID 104755796
1-cyclopentyl-2-methylsulfanylethanamine
CID 62691520
2-(2-amino-2-cyclopentylethyl)sulfanyl-4-methyl-1H-pyrimidin-6-one
CID 136913797
1-cyclohexyl-2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]ethanamine
CID 113449523
1-cyclohexyl-2-(2-methylphenyl)sulfanylethanamine
CID 66096114
N-[2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanylmethyl]prop-2-enyl]cyclopropanamine
CID 103068689
1-cyclopentyl-2-(1-methylpyrazol-4-yl)sulfanylethanamine
CID 104755777
1-cyclohexyl-2-(3,4-dimethylphenyl)sulfanylethanamine
CID 104755358

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine?
The IUPAC name of 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine (CID 104755990) is 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine.
What is the SMILES notation for 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine?
The canonical SMILES for 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine is Cc1nsc(SCC(N)C2CCCC2)n1.
What is the InChIKey of 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine?
The InChIKey is FUCMBBJQWRDJDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3S2/c1-7-12-10(15-13-7)14-6-9(11)8-4-2-3-5-8/h8-9H,2-6,11H2,1H3.
What are the key properties of 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine?
1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine has a molecular weight of 243.40 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]ethanamine is sourced from PubChem (CID 104755990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).