2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol

C14H24N2OS — CID 62015035

IUPAC2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol
SMILESCCc1nc(CN(CCO)C2CCCCC2)cs1
InChIInChI=1S/C14H24N2OS/c1-2-14-15-12(11-18-14)10-16(8-9-17)13-6-4-3-5-7-13/h11,13,17H,2-10H2,1H3
InChIKeyNMQFJVITZPQNRP-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.83
Rot. Bonds6

About 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol

2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol (PubChem CID 62015035) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol
PubChem CID62015035
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC Name2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol
SMILESCCc1nc(CN(CCO)C2CCCCC2)cs1
InChIInChI=1S/C14H24N2OS/c1-2-14-15-12(11-18-14)10-16(8-9-17)13-6-4-3-5-7-13/h11,13,17H,2-10H2,1H3
InChIKeyNMQFJVITZPQNRP-UHFFFAOYSA-N
XLogP2.83
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol?
The IUPAC name of 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol (CID 62015035) is 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol is CCc1nc(CN(CCO)C2CCCCC2)cs1.
What is the InChIKey of 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol?
The InChIKey is NMQFJVITZPQNRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-2-14-15-12(11-18-14)10-16(8-9-17)13-6-4-3-5-7-13/h11,13,17H,2-10H2,1H3.
What are the key properties of 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol?
2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol has a molecular weight of 268.43 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl-[(2-ethyl-1,3-thiazol-4-yl)methyl]amino]ethanol is sourced from PubChem (CID 62015035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).