[2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol

C15H24N2OS — CID 63916638

IUPAC[2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol
SMILESCCN(c1nc(C2CC2)c(CO)s1)C1CCCCC1
InChIInChI=1S/C15H24N2OS/c1-2-17(12-6-4-3-5-7-12)15-16-14(11-8-9-11)13(10-18)19-15/h11-12,18H,2-10H2,1H3
InChIKeyGMZCLUWPTAMWIV-UHFFFAOYSA-N
MW280.44 g/mol
LogP3.67
Rot. Bonds5

About [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol

[2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol (PubChem CID 63916638) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol
PubChem CID63916638
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name[2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol
SMILESCCN(c1nc(C2CC2)c(CO)s1)C1CCCCC1
InChIInChI=1S/C15H24N2OS/c1-2-17(12-6-4-3-5-7-12)15-16-14(11-8-9-11)13(10-18)19-15/h11-12,18H,2-10H2,1H3
InChIKeyGMZCLUWPTAMWIV-UHFFFAOYSA-N
XLogP3.67
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-chloro-2-[cyclopentyl(ethyl)amino]-1,3-thiazol-5-yl]methanol
CID 80692298
[2-[cyclohexyl(ethyl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 79392778
[2-[cyclohexyl(ethyl)amino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
CID 107510864
N,4-dicyclopropyl-N-ethyl-5-[(2-methylpropylamino)methyl]-1,3-thiazol-2-amine
CID 63917342
[4-cyclopropyl-2-[methyl(4-methylpentan-2-yl)amino]-1,3-thiazol-5-yl]methanol
CID 63915868
[4-cyclopropyl-2-[2-(dimethylamino)ethyl-propylamino]-1,3-thiazol-5-yl]methanol
CID 63917040
[4-cyclopropyl-2-[methyl(3-methylbutyl)amino]-1,3-thiazol-5-yl]methanol
CID 63917237
N-cyclopentyl-N,4-diethyl-5-(methylaminomethyl)-1,3-thiazol-2-amine
CID 62766939
(2-tert-butyl-4-cyclopropyl-1,3-thiazol-5-yl)methanol
CID 82436959
(2-bromo-4-cyclopropyl-1,3-thiazol-5-yl)methanol
CID 142609313
4-tert-butyl-2-[cyclohexyl(ethyl)amino]-1,3-thiazole-5-carbaldehyde
CID 63512549
[4-cyclopropyl-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-1,3-thiazol-5-yl]methanol
CID 63918393

Frequently Asked Questions

What is the IUPAC name of [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol (CID 63916638) is [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol is CCN(c1nc(C2CC2)c(CO)s1)C1CCCCC1.
What is the InChIKey of [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol?
The InChIKey is GMZCLUWPTAMWIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-2-17(12-6-4-3-5-7-12)15-16-14(11-8-9-11)13(10-18)19-15/h11-12,18H,2-10H2,1H3.
What are the key properties of [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol?
[2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol has a molecular weight of 280.44 g/mol, XLogP of 3.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[cyclohexyl(ethyl)amino]-4-cyclopropyl-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 63916638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).