N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine

C12H18N2O2S2 — CID 65049862

IUPACN-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCS(=O)(=O)C1CCCC1(NC1CC1)c1nccs1
InChIInChI=1S/C12H18N2O2S2/c1-18(15,16)10-3-2-6-12(10,14-9-4-5-9)11-13-7-8-17-11/h7-10,14H,2-6H2,1H3
InChIKeyJEHIDBTYEXZUCB-UHFFFAOYSA-N
MW286.42 g/mol
LogP1.69
Rot. Bonds4

About N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine

N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine (PubChem CID 65049862) has the molecular formula C12H18N2O2S2 and a molecular weight of 286.42 g/mol. Its IUPAC name is N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
PubChem CID65049862
Molecular FormulaC12H18N2O2S2
Molecular Weight286.42 g/mol
Exact Mass286.08
IUPAC NameN-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
SMILESCS(=O)(=O)C1CCCC1(NC1CC1)c1nccs1
InChIInChI=1S/C12H18N2O2S2/c1-18(15,16)10-3-2-6-12(10,14-9-4-5-9)11-13-7-8-17-11/h7-10,14H,2-6H2,1H3
InChIKeyJEHIDBTYEXZUCB-UHFFFAOYSA-N
XLogP1.69
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclopropyl-2-methyl-3-(1,3-thiazol-2-yl)thian-3-amine
CID 79951354
N-cyclopropyl-2-phenyl-1-(1,3-thiazol-2-yl)cyclohexan-1-amine
CID 105402382
N-cyclopropyl-1-(1,3-thiazol-2-yl)cyclohexan-1-amine
CID 61334064
2-methylsulfonyl-1-(4-propan-2-yl-1,3-thiazol-2-yl)-N-propylcyclopentan-1-amine
CID 65045364
N-cyclopropyl-3-methyl-1-(1,3-thiazol-2-yl)cyclobutan-1-amine
CID 103563943
N-cyclopropyl-3-ethyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine
CID 64516678
2-phenyl-N-propan-2-yl-1-(1,3-thiazol-2-yl)cyclohexan-1-amine
CID 105402369
N-cyclopropyl-1-ethyl-4-(1,3-thiazol-2-yl)azepan-4-amine
CID 65077299
N-methyl-1-(1,3-thiazol-2-yl)-2,3,5,6,7,8-hexahydropyrrolizin-1-amine
CID 82856477
N,3-dimethyl-4-(1,3-thiazol-2-yl)piperidin-4-amine
CID 114501724
2-methyl-1-(1,3-thiazol-2-yl)cyclopentane-1-carboxylic acid
CID 130948762
N,2,3-trimethyl-1-(1,3-thiazol-2-yl)cyclobutan-1-amine
CID 130877388

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The IUPAC name of N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine (CID 65049862) is N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine.
What is the SMILES notation for N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The canonical SMILES for N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine is CS(=O)(=O)C1CCCC1(NC1CC1)c1nccs1.
What is the InChIKey of N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
The InChIKey is JEHIDBTYEXZUCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2S2/c1-18(15,16)10-3-2-6-12(10,14-9-4-5-9)11-13-7-8-17-11/h7-10,14H,2-6H2,1H3.
What are the key properties of N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine?
N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine has a molecular weight of 286.42 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methylsulfonyl-1-(1,3-thiazol-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 65049862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).