[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine

C10H16N2S2 — CID 43530674

IUPAC[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine
SMILESCc1csc(SC2CCCC2CN)n1
InChIInChI=1S/C10H16N2S2/c1-7-6-13-10(12-7)14-9-4-2-3-8(9)5-11/h6,8-9H,2-5,11H2,1H3
InChIKeyQXRAXHCWSMHALI-UHFFFAOYSA-N
MW228.39 g/mol
LogP2.67
Rot. Bonds3

About [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine

[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine (PubChem CID 43530674) has the molecular formula C10H16N2S2 and a molecular weight of 228.39 g/mol. Its IUPAC name is [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine.

Molecular Properties

Compound Name[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine
PubChem CID43530674
Molecular FormulaC10H16N2S2
Molecular Weight228.39 g/mol
Exact Mass228.08
IUPAC Name[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine
SMILESCc1csc(SC2CCCC2CN)n1
InChIInChI=1S/C10H16N2S2/c1-7-6-13-10(12-7)14-9-4-2-3-8(9)5-11/h6,8-9H,2-5,11H2,1H3
InChIKeyQXRAXHCWSMHALI-UHFFFAOYSA-N
XLogP2.67
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.39
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-Fluoro-4-(4-methyl-1,3-thiazol-2-yl)-2-propan-2-ylbutan-1-amine
CID 107443532
3-Fluoro-3-[(4-methyl-1,3-thiazol-2-yl)methyl]cyclopentan-1-amine
CID 112565624
2-Fluoro-2-[(4-methyl-1,3-thiazol-2-yl)methyl]pentan-1-amine
CID 112567721
N-(cyclopentylmethyl)-1-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine
CID 72111136
2-Cyclopentyl-4-(((N-ethyl)amino)methyl)thiazole
CID 18759118
N-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclohexanamine
CID 20378728
1-(4-methyl-1,3-thiazol-2-yl)-N-propan-2-ylcyclopentan-1-amine
CID 61335208
(1R,3S)-3-(4-methylthiazol-2-yl)cyclopentanamine hydrochloride
CID 68313408
cis-(1R,3S)-3-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine
CID 68313409
(cis)-3-(4-Methylthiazol-2-yl)cyclopentanamine hydrochloride
CID 68313423
3-(4-Methyl-1,3-thiazol-2-yl)cyclopentan-1-amine;hydrochloride
CID 68313425
trans-(1S,3S)-3-(4-methyl-1,3-thiazol-2-yl)cyclopentan-1-amine;hydrochloride
CID 68313597

Frequently Asked Questions

What is the IUPAC name of [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine?
The IUPAC name of [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine (CID 43530674) is [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine.
What is the SMILES notation for [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine?
The canonical SMILES for [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine is Cc1csc(SC2CCCC2CN)n1.
What is the InChIKey of [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine?
The InChIKey is QXRAXHCWSMHALI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2S2/c1-7-6-13-10(12-7)14-9-4-2-3-8(9)5-11/h6,8-9H,2-5,11H2,1H3.
What are the key properties of [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine?
[2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine has a molecular weight of 228.39 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]cyclopentyl]methanamine is sourced from PubChem (CID 43530674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).