N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine

C14H24N2S — CID 54932016

IUPACN-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
SMILESCc1nc(C(C)NCCC2CCCCC2)cs1
InChIInChI=1S/C14H24N2S/c1-11(14-10-17-12(2)16-14)15-9-8-13-6-4-3-5-7-13/h10-11,13,15H,3-9H2,1-2H3
InChIKeyKZBRUNSCBHGTSC-UHFFFAOYSA-N
MW252.43 g/mol
LogP4.07
Rot. Bonds5

About N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine

N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine (PubChem CID 54932016) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
PubChem CID54932016
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC NameN-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
SMILESCc1nc(C(C)NCCC2CCCCC2)cs1
InChIInChI=1S/C14H24N2S/c1-11(14-10-17-12(2)16-14)15-9-8-13-6-4-3-5-7-13/h10-11,13,15H,3-9H2,1-2H3
InChIKeyKZBRUNSCBHGTSC-UHFFFAOYSA-N
XLogP4.07
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(cyclobutylmethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 43670306
N'-cyclopentyl-N'-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]ethane-1,2-diamine
CID 63314805
N'-cyclohexyl-N'-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]propane-1,3-diamine
CID 60981235
2-cyclohexyl-N-methyl-1-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 105135487
N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]butan-1-amine
CID 43670043
2,2-difluoro-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]ethanamine
CID 115405653
N-(2-cyclohexylethyl)-1-(4-iodophenyl)ethanamine
CID 63448536
2-methyl-3-[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]propane-1,2-diol
CID 66168316
tert-butyl 2-[[1-(2-methyl-1,3-thiazol-4-yl)ethylamino]methyl]piperidine-1-carboxylate
CID 103822890
1-(2-methyl-1,3-thiazol-4-yl)-N-(2-pyridin-4-ylethyl)ethanamine
CID 54944257
(1R)-1-(4-bromophenyl)-N-(2-cyclohexylethyl)ethanamine
CID 81354090
1-(2-methyl-1,3-thiazol-4-yl)-N-[(2-methylthiolan-2-yl)methyl]ethanamine
CID 80726824

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The IUPAC name of N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine (CID 54932016) is N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine.
What is the SMILES notation for N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The canonical SMILES for N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine is Cc1nc(C(C)NCCC2CCCCC2)cs1.
What is the InChIKey of N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
The InChIKey is KZBRUNSCBHGTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-11(14-10-17-12(2)16-14)15-9-8-13-6-4-3-5-7-13/h10-11,13,15H,3-9H2,1-2H3.
What are the key properties of N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine?
N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine has a molecular weight of 252.43 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-1-(2-methyl-1,3-thiazol-4-yl)ethanamine is sourced from PubChem (CID 54932016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).