1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one

C24H42N6O — CID 142081499

IUPAC1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one
SMILESCc1nc(C)nc(C(C)(C)N(CCN2CC(C)(C)NC(C)(C)C2=O)C2CCCCC2)n1
InChIInChI=1S/C24H42N6O/c1-17-25-18(2)27-20(26-17)24(7,8)30(19-12-10-9-11-13-19)15-14-29-16-22(3,4)28-23(5,6)21(29)31/h19,28H,9-16H2,1-8H3
InChIKeyCZYLBULYGSFUMV-UHFFFAOYSA-N
MW430.64 g/mol
LogP3.35
Rot. Bonds6

About 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one

1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one (PubChem CID 142081499) has the molecular formula C24H42N6O and a molecular weight of 430.64 g/mol. Its IUPAC name is 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one.

Molecular Properties

Compound Name1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one
PubChem CID142081499
Molecular FormulaC24H42N6O
Molecular Weight430.64 g/mol
Exact Mass430.34
IUPAC Name1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one
SMILESCc1nc(C)nc(C(C)(C)N(CCN2CC(C)(C)NC(C)(C)C2=O)C2CCCCC2)n1
InChIInChI=1S/C24H42N6O/c1-17-25-18(2)27-20(26-17)24(7,8)30(19-12-10-9-11-13-19)15-14-29-16-22(3,4)28-23(5,6)21(29)31/h19,28H,9-16H2,1-8H3
InChIKeyCZYLBULYGSFUMV-UHFFFAOYSA-N
XLogP3.35
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.64
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one with MolForge

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Launch Full Analysis

Related Compounds

Piperazinone, 1,1',1''-(1,3,5-triazine-2,4,6-triyltris((cyclohexylimino)-2,1-ethanediyl))tris(3,3,5,5-tetramethyl-
CID 20673357
2-[4-[1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]piperazin-1-yl]-N-cyclopropylpropanamide
CID 42929906
1-[3-[4,6-Bis[1-(cyclohexylamino)-3-(3,3,5,5-tetramethyl-2-oxopiperazin-1-yl)propyl]-1,3,5-triazin-2-yl]-3-(cyclohexylamino)propyl]-3,3,5,5-tetramethylpiperazin-2-one
CID 20153003
1-[2-[Cyclohexyl-(4,6-dichloro-1,3,5-triazin-2-yl)amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one
CID 20153028
1-[2-[[4-Chloro-6-(cyclohexylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropyl]-3,3,5,5-tetramethylpiperazin-2-one
CID 20225391
1-[2-[[4,6-Bis(cyclohexylamino)-1,3,5-triazin-2-yl]amino]-2-methylpropyl]-3,3,5,5-tetramethylpiperazin-2-one
CID 20225393
1-[2-[[4-(Dibutylamino)-6-methyl-1,3,5-triazin-2-yl]-[2-(3,3,5,5-tetramethyl-2,6-dioxopiperazin-1-yl)ethyl]amino]ethyl]-3,3,5,5-tetramethylpiperazine-2,6-dione
CID 20741641
1-[2-[Cyclohexyl-(4,6-dimethyl-1,3,5-triazin-2-yl)amino]ethyl]-3,3,4,5,5-pentamethylpiperazin-2-one
CID 20768143
1-[2-[Cyclohexyl-(4,6-dimethyl-1,3,5-triazin-2-yl)amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one
CID 20768144
1-[2-[6-[[4-(Tert-butylamino)-6-methyl-1,3,5-triazin-2-yl]-[1-(3,3,4,5,5-pentamethyl-2-oxopiperazin-1-yl)propan-2-yl]amino]hexyl-methylamino]propyl]-3,3,4,5,5-pentamethylpiperazin-2-one
CID 21136884
1-[2-[6-[[4-(Tert-butylamino)-6-methyl-1,3,5-triazin-2-yl]-[2-(3,3,4,5,5-pentamethyl-2-oxopiperazin-1-yl)ethyl]amino]hexyl-methylamino]ethyl]-3,3,4,5,5-pentamethylpiperazin-2-one
CID 21136885
1-[2-[6-[[4-(Tert-butylamino)-6-methyl-1,3,5-triazin-2-yl]-[1-(3,3,5,5-tetramethyl-2-oxopiperazin-1-yl)propan-2-yl]amino]hexyl-methylamino]propyl]-3,3,5,5-tetramethylpiperazin-2-one
CID 21136887

Frequently Asked Questions

What is the IUPAC name of 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one?
The IUPAC name of 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one (CID 142081499) is 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one.
What is the SMILES notation for 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one?
The canonical SMILES for 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one is Cc1nc(C)nc(C(C)(C)N(CCN2CC(C)(C)NC(C)(C)C2=O)C2CCCCC2)n1.
What is the InChIKey of 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one?
The InChIKey is CZYLBULYGSFUMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H42N6O/c1-17-25-18(2)27-20(26-17)24(7,8)30(19-12-10-9-11-13-19)15-14-29-16-22(3,4)28-23(5,6)21(29)31/h19,28H,9-16H2,1-8H3.
What are the key properties of 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one?
1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one has a molecular weight of 430.64 g/mol, XLogP of 3.35, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[cyclohexyl-[2-(4,6-dimethyl-1,3,5-triazin-2-yl)propan-2-yl]amino]ethyl]-3,3,5,5-tetramethylpiperazin-2-one is sourced from PubChem (CID 142081499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).