2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine

C14H26N6O — CID 80804461

IUPAC2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine
SMILESCCNc1nc(NCC2CCOC2)nc(N(CC)CC)n1
InChIInChI=1S/C14H26N6O/c1-4-15-12-17-13(16-9-11-7-8-21-10-11)19-14(18-12)20(5-2)6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyXZUQVYSSIGVSNQ-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.60
Rot. Bonds8

About 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine

2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine (PubChem CID 80804461) has the molecular formula C14H26N6O and a molecular weight of 294.40 g/mol. Its IUPAC name is 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine
PubChem CID80804461
Molecular FormulaC14H26N6O
Molecular Weight294.40 g/mol
Exact Mass294.22
IUPAC Name2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine
SMILESCCNc1nc(NCC2CCOC2)nc(N(CC)CC)n1
InChIInChI=1S/C14H26N6O/c1-4-15-12-17-13(16-9-11-7-8-21-10-11)19-14(18-12)20(5-2)6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18,19)
InChIKeyXZUQVYSSIGVSNQ-UHFFFAOYSA-N
XLogP1.60
TPSA75.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine with MolForge

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Launch Full Analysis

Related Compounds

4-N-(2-cyclopropylethyl)-2-N,2-N,6-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80847684
4-N-(1,4-dioxan-2-ylmethyl)-2-N,2-N-diethyl-6-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 80773943
6-ethoxy-4-N-ethyl-2-N-(oxan-3-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80814333
4-N-ethyl-2-N-(oxan-4-ylmethyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80818729
4-N-methyl-2-N-(oxolan-3-ylmethyl)-6-pyrazol-1-yl-1,3,5-triazine-2,4-diamine
CID 80823144
6-chloro-4-N-ethyl-2-N-methyl-2-N-(oxan-3-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80846060
6-N-methyl-4-N-(oxolan-3-ylmethyl)-2-propylpyrimidine-4,6-diamine
CID 80955245
5-methyl-4-N-(oxolan-3-ylmethyl)-6-N,2-dipropylpyrimidine-4,6-diamine
CID 80985429
6-N,5-dimethyl-4-N-(oxolan-3-ylmethyl)-2-propylpyrimidine-4,6-diamine
CID 80983011
4-N-(2,3-dimethylbutyl)-2-N,2-N,6-N-triethyl-1,3,5-triazine-2,4,6-triamine
CID 80825421
2-N,2-N,6-N-triethyl-4-N-(3-methylbutyl)-1,3,5-triazine-2,4,6-triamine
CID 80785774
5-iodo-N-(oxolan-3-ylmethyl)pyrimidin-2-amine
CID 104841332

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine (CID 80804461) is 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine is CCNc1nc(NCC2CCOC2)nc(N(CC)CC)n1.
What is the InChIKey of 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine?
The InChIKey is XZUQVYSSIGVSNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6O/c1-4-15-12-17-13(16-9-11-7-8-21-10-11)19-14(18-12)20(5-2)6-3/h11H,4-10H2,1-3H3,(H2,15,16,17,18,19).
What are the key properties of 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine?
2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine has a molecular weight of 294.40 g/mol, XLogP of 1.60, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N,6-N-triethyl-4-N-(oxolan-3-ylmethyl)-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 80804461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).