2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine

C18H32N6 — CID 23762363

IUPAC2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
SMILESCCCNc1nc(NC2CCCCC2)nc(NC2CCCCC2)n1
InChIInChI=1S/C18H32N6/c1-2-13-19-16-22-17(20-14-9-5-3-6-10-14)24-18(23-16)21-15-11-7-4-8-12-15/h14-15H,2-13H2,1H3,(H3,19,20,21,22,23,24)
InChIKeyCOVAOUDLLZAJLU-UHFFFAOYSA-N
MW332.50 g/mol
LogP4.18
Rot. Bonds7

About 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine

2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 23762363) has the molecular formula C18H32N6 and a molecular weight of 332.50 g/mol. Its IUPAC name is 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
PubChem CID23762363
Molecular FormulaC18H32N6
Molecular Weight332.50 g/mol
Exact Mass332.27
IUPAC Name2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
SMILESCCCNc1nc(NC2CCCCC2)nc(NC2CCCCC2)n1
InChIInChI=1S/C18H32N6/c1-2-13-19-16-22-17(20-14-9-5-3-6-10-14)24-18(23-16)21-15-11-7-4-8-12-15/h14-15H,2-13H2,1H3,(H3,19,20,21,22,23,24)
InChIKeyCOVAOUDLLZAJLU-UHFFFAOYSA-N
XLogP4.18
TPSA74.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.50
LogP ≤ 54.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

6-Chloro-N-cyclohexyl-N'-ethyl-1,3,5-triazine-2,4-diamine
CID 158453
N-tert-Butyl-6-chloro-N'-cyclohexyl-[1,3,5]triazine-2,4-diamine
CID 535317
6-chloro-N4-cyclohexyl-N2-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 779462
N-Octadecyl-1,3,5-triazine-2,4,6-triamine
CID 89073
6-(azepan-1-yl)-2-N,4-N-di(butan-2-yl)-1,3,5-triazine-2,4-diamine
CID 3094336
6-chloro-2-N-cyclohexyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 71727294
6-Chloro-N(2),N(4)-dicyclohexyl-1,3,5-triazine-2,4-diamine
CID 245174
s-Triazine, 2-amino-4-(cyclohexylamino)-6-(dimethylamino)-
CID 207596
N-Cyclohexyl-6-(cyclohexylimino)-4-methyl-1,6-dihydro-1,3,5-triazin-2-amine
CID 213566
N~2~,N~4~-Dicyclohexyl-6-propyl-1,3,5-triazine-2,4(1H,3H)-diimine
CID 213571
N~2~-Cyclohexyl-N~4~-methyl-1,3,5-triazinane-2,4,6-triimine
CID 213573
6-(azocan-1-yl)-4-N-cyclohexyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 44533866

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine (CID 23762363) is 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine is CCCNc1nc(NC2CCCCC2)nc(NC2CCCCC2)n1.
What is the InChIKey of 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is COVAOUDLLZAJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N6/c1-2-13-19-16-22-17(20-14-9-5-3-6-10-14)24-18(23-16)21-15-11-7-4-8-12-15/h14-15H,2-13H2,1H3,(H3,19,20,21,22,23,24).
What are the key properties of 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine?
2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 332.50 g/mol, XLogP of 4.18, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dicyclohexyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 23762363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).