4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine

C14H20N6O — CID 80773721

IUPAC4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine
SMILESCCNc1nc(OC)nc(N(C)CCc2ccncc2)n1
InChIInChI=1S/C14H20N6O/c1-4-16-12-17-13(19-14(18-12)21-3)20(2)10-7-11-5-8-15-9-6-11/h5-6,8-9H,4,7,10H2,1-3H3,(H,16,17,18,19)
InChIKeyCBTHRLIGCVJCAX-UHFFFAOYSA-N
MW288.36 g/mol
LogP1.39
Rot. Bonds7

About 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine

4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 80773721) has the molecular formula C14H20N6O and a molecular weight of 288.36 g/mol. Its IUPAC name is 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine
PubChem CID80773721
Molecular FormulaC14H20N6O
Molecular Weight288.36 g/mol
Exact Mass288.17
IUPAC Name4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine
SMILESCCNc1nc(OC)nc(N(C)CCc2ccncc2)n1
InChIInChI=1S/C14H20N6O/c1-4-16-12-17-13(19-14(18-12)21-3)20(2)10-7-11-5-8-15-9-6-11/h5-6,8-9H,4,7,10H2,1-3H3,(H,16,17,18,19)
InChIKeyCBTHRLIGCVJCAX-UHFFFAOYSA-N
XLogP1.39
TPSA76.06 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]ethanol
CID 80771509
6-ethoxy-4-N-ethyl-2-N-methyl-2-N-(2-thiophen-2-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80837827
4-N-[2-(4-methoxyphenyl)ethyl]-2-N-methyl-2-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 112895350
2-N-methyl-6-propan-2-yloxy-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80773890
2-N,2-N-dibutyl-4-N-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 80753763
2-N-ethyl-6-imidazol-1-yl-4-N-(3-methoxypropyl)-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80809214
4-[2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]amino]ethyl]phenol
CID 80776333
4-N-tert-butyl-2-N,6-dimethyl-2-N-(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 112921587
2-N-ethyl-6-imidazol-1-yl-4-N-methyl-4-N-(3-methylbutyl)-1,3,5-triazine-2,4-diamine
CID 80780584
2-N,4-N,6-trimethyl-2-N,4-N-bis(2-pyridin-4-ylethyl)pyrimidine-2,4-diamine
CID 112921458
2-N-(3,3-dimethylbutan-2-yl)-4-N-ethyl-6-methoxy-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 80815170
4-N-ethyl-6-methoxy-2-N-propan-2-yl-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80776462

Frequently Asked Questions

What is the IUPAC name of 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine (CID 80773721) is 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine is CCNc1nc(OC)nc(N(C)CCc2ccncc2)n1.
What is the InChIKey of 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is CBTHRLIGCVJCAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-4-16-12-17-13(19-14(18-12)21-3)20(2)10-7-11-5-8-15-9-6-11/h5-6,8-9H,4,7,10H2,1-3H3,(H,16,17,18,19).
What are the key properties of 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine?
4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 288.36 g/mol, XLogP of 1.39, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-ethyl-6-methoxy-2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80773721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).