4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine

C19H26N6OS — CID 165433099

IUPAC4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine
SMILESCc1cc(N2CCN(c3nc4c(s3)CCC4)CC2)nc(N2CCOCC2)n1
InChIInChI=1S/C19H26N6OS/c1-14-13-17(22-18(20-14)24-9-11-26-12-10-24)23-5-7-25(8-6-23)19-21-15-3-2-4-16(15)27-19/h13H,2-12H2,1H3
InChIKeyYZYFZXGKTKIRIB-UHFFFAOYSA-N
MW386.53 g/mol
LogP1.89
Rot. Bonds3

About 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine

4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine (PubChem CID 165433099) has the molecular formula C19H26N6OS and a molecular weight of 386.53 g/mol. Its IUPAC name is 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine
PubChem CID165433099
Molecular FormulaC19H26N6OS
Molecular Weight386.53 g/mol
Exact Mass386.19
IUPAC Name4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine
SMILESCc1cc(N2CCN(c3nc4c(s3)CCC4)CC2)nc(N2CCOCC2)n1
InChIInChI=1S/C19H26N6OS/c1-14-13-17(22-18(20-14)24-9-11-26-12-10-24)23-5-7-25(8-6-23)19-21-15-3-2-4-16(15)27-19/h13H,2-12H2,1H3
InChIKeyYZYFZXGKTKIRIB-UHFFFAOYSA-N
XLogP1.89
TPSA57.62 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.53
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

4-[6-methyl-2-[4-(3-methyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]pyrimidin-4-yl]morpholine
CID 163345543
2-[4-(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)piperazin-1-yl]-5,6,7,8-tetrahydroquinoline-3-carbonitrile
CID 146079860
4-[4-methyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-yl]morpholine
CID 112912286
4-[2-(4-ethylsulfonylpiperazin-1-yl)-6-methylpyrimidin-4-yl]morpholine
CID 27656202
1-[[4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazin-1-yl]methyl]cyclobutan-1-ol
CID 163351063
2-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 165433014
N,N-dimethyl-4-(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)piperazine-1-sulfonamide
CID 50947311
4-[2-[4-(5,6-dimethylpyrimidin-4-yl)piperazin-1-yl]-6-methylpyrimidin-4-yl]morpholine
CID 146074348
4-[2-[4-(5-chloro-2-pyridinyl)piperazin-1-yl]-6-methylpyrimidin-4-yl]morpholine
CID 166601129
4-(2-morpholin-4-yl-6-pyrrolidin-1-ylpyrimidin-4-yl)morpholine
CID 67897493
4-[6-methyl-2-(4-quinoxalin-2-ylpiperazin-1-yl)pyrimidin-4-yl]morpholine
CID 154883227
2-[4-[6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]piperazin-1-yl]-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole
CID 165433794

Frequently Asked Questions

What is the IUPAC name of 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine?
The IUPAC name of 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine (CID 165433099) is 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine.
What is the SMILES notation for 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine?
The canonical SMILES for 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine is Cc1cc(N2CCN(c3nc4c(s3)CCC4)CC2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine?
The InChIKey is YZYFZXGKTKIRIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6OS/c1-14-13-17(22-18(20-14)24-9-11-26-12-10-24)23-5-7-25(8-6-23)19-21-15-3-2-4-16(15)27-19/h13H,2-12H2,1H3.
What are the key properties of 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine?
4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine has a molecular weight of 386.53 g/mol, XLogP of 1.89, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[4-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)piperazin-1-yl]-6-methylpyrimidin-2-yl]morpholine is sourced from PubChem (CID 165433099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).