4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol

C14H24N2OS — CID 28641675

IUPAC4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol
SMILESCc1csc([C@H](C)N(C)CC2CCC(O)CC2)n1
InChIInChI=1S/C14H24N2OS/c1-10-9-18-14(15-10)11(2)16(3)8-12-4-6-13(17)7-5-12/h9,11-13,17H,4-8H2,1-3H3/t11-,12?,13?/m0/s1
InChIKeyFYQJTPICKHHAMJ-HIFPTAJRSA-N
MW268.43 g/mol
LogP3.00
Rot. Bonds4

About 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol

4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol (PubChem CID 28641675) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol
PubChem CID28641675
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC Name4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol
SMILESCc1csc([C@H](C)N(C)CC2CCC(O)CC2)n1
InChIInChI=1S/C14H24N2OS/c1-10-9-18-14(15-10)11(2)16(3)8-12-4-6-13(17)7-5-12/h9,11-13,17H,4-8H2,1-3H3/t11-,12?,13?/m0/s1
InChIKeyFYQJTPICKHHAMJ-HIFPTAJRSA-N
XLogP3.00
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol?
The IUPAC name of 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol (CID 28641675) is 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol is Cc1csc([C@H](C)N(C)CC2CCC(O)CC2)n1.
What is the InChIKey of 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol?
The InChIKey is FYQJTPICKHHAMJ-HIFPTAJRSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-10-9-18-14(15-10)11(2)16(3)8-12-4-6-13(17)7-5-12/h9,11-13,17H,4-8H2,1-3H3/t11-,12?,13?/m0/s1.
What are the key properties of 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol?
4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol has a molecular weight of 268.43 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[methyl-[(1S)-1-(4-methyl-1,3-thiazol-2-yl)ethyl]amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 28641675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).