cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine

C11H18N2S — CID 43559031

IUPACcyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine
SMILESCc1cnc(C(N)C2CCCCC2)s1
InChIInChI=1S/C11H18N2S/c1-8-7-13-11(14-8)10(12)9-5-3-2-4-6-9/h7,9-10H,2-6,12H2,1H3
InChIKeyILMQNTTWYQFAFL-UHFFFAOYSA-N
MW210.35 g/mol
LogP3.03
Rot. Bonds2

About cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine

cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine (PubChem CID 43559031) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine.

Molecular Properties

Compound Namecyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine
PubChem CID43559031
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Namecyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine
SMILESCc1cnc(C(N)C2CCCCC2)s1
InChIInChI=1S/C11H18N2S/c1-8-7-13-11(14-8)10(12)9-5-3-2-4-6-9/h7,9-10H,2-6,12H2,1H3
InChIKeyILMQNTTWYQFAFL-UHFFFAOYSA-N
XLogP3.03
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(5-methyl-1,3-thiazol-2-yl)ethanamine
CID 42252000
N-[(5-methyl-1,3-thiazol-2-yl)methyl]cycloheptanamine
CID 115655830
cyclohexyl-(2,6-dimethyl-4-pyridinyl)methanamine
CID 107503026
2-amino-N-[1-(5-methyl-1,3-thiazol-2-yl)ethyl]cyclohexane-1-carboxamide
CID 112702025
ethyl 4-[[cyclopropyl-(5-methyl-1,3-thiazol-2-yl)methyl]amino]piperidine-1-carboxylate
CID 84596951
(R)-(5-bromo-4-methylthiophen-2-yl)-cyclohexylmethanamine
CID 171203284
1-cyclopropyl-3-[(R)-cyclopropyl-(5-methyl-1,3-thiazol-2-yl)methyl]urea
CID 96566132
cyclopentyl-(4,5-dimethylthiophen-2-yl)methanamine
CID 115778964
cyclooctyl-(2-ethoxy-5-methylphenyl)methanamine
CID 65018902
cyclooctyl-(1-ethylpyrazol-4-yl)methanamine
CID 80603190
(5-methyl-1,3-thiazol-2-yl)-(4-propan-2-ylphenyl)methanamine
CID 43558963
cyclobutyl-(4-methyl-1,3-thiazol-5-yl)methanamine
CID 83684010

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine?
The IUPAC name of cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine (CID 43559031) is cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine.
What is the SMILES notation for cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine?
The canonical SMILES for cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine is Cc1cnc(C(N)C2CCCCC2)s1.
What is the InChIKey of cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine?
The InChIKey is ILMQNTTWYQFAFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c1-8-7-13-11(14-8)10(12)9-5-3-2-4-6-9/h7,9-10H,2-6,12H2,1H3.
What are the key properties of cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine?
cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine has a molecular weight of 210.35 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(5-methyl-1,3-thiazol-2-yl)methanamine is sourced from PubChem (CID 43559031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).