2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine

C10H18N2S — CID 154476340

IUPAC2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine
SMILESNC1CSC(CC2CCCCC2)=N1
InChIInChI=1S/C10H18N2S/c11-9-7-13-10(12-9)6-8-4-2-1-3-5-8/h8-9H,1-7,11H2
InChIKeyWMDUTSZWNBDADQ-UHFFFAOYSA-N
MW198.33 g/mol
LogP2.39
Rot. Bonds2

About 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine

2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine (PubChem CID 154476340) has the molecular formula C10H18N2S and a molecular weight of 198.33 g/mol. Its IUPAC name is 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine
PubChem CID154476340
Molecular FormulaC10H18N2S
Molecular Weight198.33 g/mol
Exact Mass198.12
IUPAC Name2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine
SMILESNC1CSC(CC2CCCCC2)=N1
InChIInChI=1S/C10H18N2S/c11-9-7-13-10(12-9)6-8-4-2-1-3-5-8/h8-9H,1-7,11H2
InChIKeyWMDUTSZWNBDADQ-UHFFFAOYSA-N
XLogP2.39
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclobutylmethyl)-4,5-dihydro-1,3-thiazole
CID 123254253
dichloro(cyclohexylmethyl)silane
CID 70700060
cyclohexanamine;cyclohexylmethanamine
CID 174974863
2-(cyclooctylmethyl)-5-(dimethylamino)-5-methyl-1,3-thiazol-4-one
CID 58048393
cyclohexylmethanamine;hydrochloride
CID 3039618
cyclohexylmethanamine;hydrobromide
CID 13001131
4-(cyclohexylmethyl)-2-methyl-1,3-thiazole
CID 174858890
4-chloro-6-(cyclohexylmethyl)-1,3,5-triazin-2-amine
CID 83240446
1,3,5-tris(cyclohexylmethyl)benzene
CID 157164571
4-(cycloheptylmethyl)pyridin-2-amine
CID 82923791
5-(cyclohexylmethyl)-1,3,4-oxadiazol-2-amine
CID 28780022
2-(cyclooctylmethyl)-5-methyl-5-(2,2,2-trifluoroethyl)-1,3-thiazol-4-one
CID 58048080

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine?
The IUPAC name of 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine (CID 154476340) is 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine?
The canonical SMILES for 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine is NC1CSC(CC2CCCCC2)=N1.
What is the InChIKey of 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine?
The InChIKey is WMDUTSZWNBDADQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2S/c11-9-7-13-10(12-9)6-8-4-2-1-3-5-8/h8-9H,1-7,11H2.
What are the key properties of 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine?
2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine has a molecular weight of 198.33 g/mol, XLogP of 2.39, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylmethyl)-4,5-dihydro-1,3-thiazol-4-amine is sourced from PubChem (CID 154476340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).