N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine

C21H38N6 — CID 58788047

IUPACN-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine
SMILESCc1nc(C)nc(N(CCN2CC(C)(C)NC(C)(C)C2)C2CCCCC2)n1
InChIInChI=1S/C21H38N6/c1-16-22-17(2)24-19(23-16)27(18-10-8-7-9-11-18)13-12-26-14-20(3,4)25-21(5,6)15-26/h18,25H,7-15H2,1-6H3
InChIKeyZMNSLAMJRBIMNV-UHFFFAOYSA-N
MW374.58 g/mol
LogP3.09
Rot. Bonds5

About N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine

N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine (PubChem CID 58788047) has the molecular formula C21H38N6 and a molecular weight of 374.58 g/mol. Its IUPAC name is N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine
PubChem CID58788047
Molecular FormulaC21H38N6
Molecular Weight374.58 g/mol
Exact Mass374.32
IUPAC NameN-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine
SMILESCc1nc(C)nc(N(CCN2CC(C)(C)NC(C)(C)C2)C2CCCCC2)n1
InChIInChI=1S/C21H38N6/c1-16-22-17(2)24-19(23-16)27(18-10-8-7-9-11-18)13-12-26-14-20(3,4)25-21(5,6)15-26/h18,25H,7-15H2,1-6H3
InChIKeyZMNSLAMJRBIMNV-UHFFFAOYSA-N
XLogP3.09
TPSA57.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.58
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

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Launch Full Analysis

Related Compounds

4-(Cyclohexylamino)-6-piperazin-1-yl-1,3,5-triazine-2-carbonitrile
CID 11471738
[4-(Cyclohexylamino)-6-piperazin-4-ium-1-yl-1,3,5-triazin-2-yl]methylazanium
CID 72200123
N-Cyclohexyl-6-(cyclohexylimino)-4-methyl-1,6-dihydro-1,3,5-triazin-2-amine
CID 213566
s-Triazine, 4,6-bis(cyclohexylamino)-2-butyl-
CID 213567
Amino-[4-(cyclohexylamino)-6-piperazin-1-yl-1,3,5-triazin-2-yl]methanethiol
CID 44631848
6-[1-[4-[[butyl(methyl)amino]methyl]piperidin-1-yl]ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 53619862
4-(Cyclohexylamino)-6-piperidin-1-yl-1,3,5-triazine-2-carbonitrile
CID 11173697
6-[1-amino-3-[2-(3-aminopropylamino)ethylamino]propyl]-2-N,4-N-dibutyl-2-N,4-N-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
CID 17764008
6-[1-amino-3-[2-(3-aminopropylamino)ethylamino]propyl]-2-N,4-N-dibutyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
CID 18008716
4-N-cyclohexyl-6-methyl-2-N-[[methyl-(2,2,6,6-tetramethylpiperidin-4-yl)amino]methyl]-2-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
CID 18715894
2-N,4-N-dibutyl-6-methyl-2-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)-4-N-(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
CID 18720560
2-N,4-N,6-tributyl-2-N,4-N-bis(2,2,6,6-tetramethylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
CID 20273781

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine?
The IUPAC name of N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine (CID 58788047) is N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine.
What is the SMILES notation for N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine?
The canonical SMILES for N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine is Cc1nc(C)nc(N(CCN2CC(C)(C)NC(C)(C)C2)C2CCCCC2)n1.
What is the InChIKey of N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine?
The InChIKey is ZMNSLAMJRBIMNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H38N6/c1-16-22-17(2)24-19(23-16)27(18-10-8-7-9-11-18)13-12-26-14-20(3,4)25-21(5,6)15-26/h18,25H,7-15H2,1-6H3.
What are the key properties of N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine?
N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine has a molecular weight of 374.58 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4,6-dimethyl-N-[2-(3,3,5,5-tetramethylpiperazin-1-yl)ethyl]-1,3,5-triazin-2-amine is sourced from PubChem (CID 58788047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).