(2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine

C10H18N2S — CID 134243565

IUPAC(2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine
SMILESNCC1=CSC(C2CCCCC2)N1
InChIInChI=1S/C10H18N2S/c11-6-9-7-13-10(12-9)8-4-2-1-3-5-8/h7-8,10,12H,1-6,11H2
InChIKeyBBNOJRSNPHMWHQ-UHFFFAOYSA-N
MW198.33 g/mol
LogP2.03
Rot. Bonds2

About (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine

(2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine (PubChem CID 134243565) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine.

Molecular Properties

Compound Name(2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine
PubChem CID134243565
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC Name(2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine
SMILESNCC1=CSC(C2CCCCC2)N1
InChIInChI=1S/C10H18N2S/c11-6-9-7-13-10(12-9)8-4-2-1-3-5-8/h7-8,10,12H,1-6,11H2
InChIKeyBBNOJRSNPHMWHQ-UHFFFAOYSA-N
XLogP2.03
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine?
The IUPAC name of (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine (CID 134243565) is (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine.
What is the SMILES notation for (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine?
The canonical SMILES for (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine is NCC1=CSC(C2CCCCC2)N1.
What is the InChIKey of (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine?
The InChIKey is BBNOJRSNPHMWHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c11-6-9-7-13-10(12-9)8-4-2-1-3-5-8/h7-8,10,12H,1-6,11H2.
What are the key properties of (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine?
(2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine has a molecular weight of 198.33 g/mol, XLogP of 2.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexyl-2,3-dihydro-1,3-thiazol-4-yl)methanamine is sourced from PubChem (CID 134243565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).