(2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine

C15H24N2OS — CID 95123430

IUPAC(2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine
SMILESc1csc(CN2CCO[C@H](CC3CCCCC3)C2)n1
InChIInChI=1S/C15H24N2OS/c1-2-4-13(5-3-1)10-14-11-17(7-8-18-14)12-15-16-6-9-19-15/h6,9,13-14H,1-5,7-8,10-12H2/t14-/m1/s1
InChIKeyBBPXFEKVGZJRQU-CQSZACIVSA-N
MW280.44 g/mol
LogP3.31
Rot. Bonds4

About (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine

(2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine (PubChem CID 95123430) has the molecular formula C15H24N2OS and a molecular weight of 280.44 g/mol. Its IUPAC name is (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine.

Molecular Properties

Compound Name(2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine
PubChem CID95123430
Molecular FormulaC15H24N2OS
Molecular Weight280.44 g/mol
Exact Mass280.16
IUPAC Name(2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine
SMILESc1csc(CN2CCO[C@H](CC3CCCCC3)C2)n1
InChIInChI=1S/C15H24N2OS/c1-2-4-13(5-3-1)10-14-11-17(7-8-18-14)12-15-16-6-9-19-15/h6,9,13-14H,1-5,7-8,10-12H2/t14-/m1/s1
InChIKeyBBPXFEKVGZJRQU-CQSZACIVSA-N
XLogP3.31
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.44
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4S,5S)-4-(ethoxymethyl)-9-(1,3-thiazol-2-ylmethyl)-6-oxa-9-azaspiro[4.5]decane
CID 97375125
(2S,3aS,7aS)-2-methyl-6-(1,3-thiazol-2-ylmethyl)-3,3a,4,5,7,7a-hexahydro-2H-furo[2,3-c]pyridine
CID 97385057
(2R,3aS,7aS)-2-methyl-6-(1,3-thiazol-2-ylmethyl)-3,3a,4,5,7,7a-hexahydro-2H-furo[2,3-c]pyridine
CID 97392664
N,N-dimethyl-8-(1,3-thiazol-2-ylmethyl)-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 118745959
2-(Cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine
CID 50956237
(4aR,8S,8aR)-8-pyrrolidin-1-yl-6-(1,3-thiazol-2-ylmethyl)-2,3,4,4a,5,7,8,8a-octahydropyrano[3,2-c]pyridine
CID 133144260
Morpholine, 4-[1-(2-thiazolyl)cycloheptyl]-
CID 3725477
Morpholine, 4-[1-propyl-1-(2-thiazolyl)butyl]-
CID 3784455
Morpholine, 4-[1-(2-thiazolyl)cyclohexyl]-
CID 3816979
3-Cyclohexyl-1-(1,3-thiazol-2-yl)propan-1-ol
CID 19821658
(1R)-3-cyclohexyl-1-(1,3-thiazol-2-yl)propan-1-ol
CID 22843366
2-[1-(Oxan-2-ylmethyl)piperidin-4-yl]-1,3-thiazole
CID 141412758

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine?
The IUPAC name of (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine (CID 95123430) is (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine.
What is the SMILES notation for (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine?
The canonical SMILES for (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine is c1csc(CN2CCO[C@H](CC3CCCCC3)C2)n1.
What is the InChIKey of (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine?
The InChIKey is BBPXFEKVGZJRQU-CQSZACIVSA-N. The full InChI is InChI=1S/C15H24N2OS/c1-2-4-13(5-3-1)10-14-11-17(7-8-18-14)12-15-16-6-9-19-15/h6,9,13-14H,1-5,7-8,10-12H2/t14-/m1/s1.
What are the key properties of (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine?
(2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine has a molecular weight of 280.44 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(cyclohexylmethyl)-4-(1,3-thiazol-2-ylmethyl)morpholine is sourced from PubChem (CID 95123430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).