cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone

C19H30N4O2S — CID 53158614

IUPACcyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone
SMILESO=C(C1CCCCC1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
InChIInChI=1S/C19H30N4O2S/c24-18(16-4-2-1-3-5-16)22-6-8-23(9-7-22)19-20-17(15-26-19)14-21-10-12-25-13-11-21/h15-16H,1-14H2
InChIKeyOQMFYAHKXZZDLJ-UHFFFAOYSA-N
MW378.54 g/mol
LogP2.20
Rot. Bonds4

About cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone

cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone (PubChem CID 53158614) has the molecular formula C19H30N4O2S and a molecular weight of 378.54 g/mol. Its IUPAC name is cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone.

Molecular Properties

Compound Namecyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone
PubChem CID53158614
Molecular FormulaC19H30N4O2S
Molecular Weight378.54 g/mol
Exact Mass378.21
IUPAC Namecyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone
SMILESO=C(C1CCCCC1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1
InChIInChI=1S/C19H30N4O2S/c24-18(16-4-2-1-3-5-16)22-6-8-23(9-7-22)19-20-17(15-26-19)14-21-10-12-25-13-11-21/h15-16H,1-14H2
InChIKeyOQMFYAHKXZZDLJ-UHFFFAOYSA-N
XLogP2.20
TPSA48.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.54
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-methyl-2-morpholin-4-ylpentyl)-1-(4-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 47080457
[2-(3-Methylpiperidin-1-yl)-1,3-thiazol-4-yl]-morpholin-4-ylmethanone
CID 53015921
[4-[4-(Azepan-1-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]-cyclohexylmethanone
CID 53158607
2-Cyclopentyl-1-[4-[4-(pyrrolidin-1-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]ethanone
CID 53158495
2-Cyclohexyl-1-{4-[4-(1-pyrrolidinylmethyl)-1,3-thiazol-2-YL]piperazino}-1-ethanone
CID 53158498
Cyclopentyl-[4-[4-(pyrrolidin-1-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone
CID 53158499
Cyclohexyl{4-[4-(piperidinomethyl)-1,3-thiazol-2-YL]piperazino}methanone
CID 53158522
2-Cyclohexyl-1-{4-[4-(piperidinomethyl)-1,3-thiazol-2-yl]piperazino}-1-ethanone
CID 53158535
Cyclobutyl-[4-[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone
CID 53158539
Cyclohexyl(4-{4-[(4-methylpiperidino)methyl]-1,3-thiazol-2-yl}piperazino)methanone
CID 53158571
Cyclopentyl-[4-[4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]piperazin-1-yl]methanone
CID 53158576
Cyclopropyl-[4-[4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]piperazin-1-yl]methanone
CID 53158577

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone?
The IUPAC name of cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone (CID 53158614) is cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone.
What is the SMILES notation for cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone?
The canonical SMILES for cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone is O=C(C1CCCCC1)N1CCN(c2nc(CN3CCOCC3)cs2)CC1.
What is the InChIKey of cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone?
The InChIKey is OQMFYAHKXZZDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O2S/c24-18(16-4-2-1-3-5-16)22-6-8-23(9-7-22)19-20-17(15-26-19)14-21-10-12-25-13-11-21/h15-16H,1-14H2.
What are the key properties of cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone?
cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone has a molecular weight of 378.54 g/mol, XLogP of 2.20, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-[4-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]piperazin-1-yl]methanone is sourced from PubChem (CID 53158614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).