2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine

C13H23N5O2 — CID 80820940

IUPAC2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine
SMILESCCOc1nc(N)nc(N(CCOC)C(C)C2CC2)n1
InChIInChI=1S/C13H23N5O2/c1-4-20-13-16-11(14)15-12(17-13)18(7-8-19-3)9(2)10-5-6-10/h9-10H,4-8H2,1-3H3,(H2,14,15,16,17)
InChIKeyUXIOKYRKASNQHG-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.10
Rot. Bonds8

About 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine

2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 80820940) has the molecular formula C13H23N5O2 and a molecular weight of 281.36 g/mol. Its IUPAC name is 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine
PubChem CID80820940
Molecular FormulaC13H23N5O2
Molecular Weight281.36 g/mol
Exact Mass281.19
IUPAC Name2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine
SMILESCCOc1nc(N)nc(N(CCOC)C(C)C2CC2)n1
InChIInChI=1S/C13H23N5O2/c1-4-20-13-16-11(14)15-12(17-13)18(7-8-19-3)9(2)10-5-6-10/h9-10H,4-8H2,1-3H3,(H2,14,15,16,17)
InChIKeyUXIOKYRKASNQHG-UHFFFAOYSA-N
XLogP1.10
TPSA86.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

6-bromo-2-N-(1-cyclopropylethyl)-2-N-(2-methoxyethyl)pyrimidine-2,4-diamine
CID 116796670
5-chloro-4-N-(1-cyclopropylethyl)-4-N-(2-methoxyethyl)pyrimidine-2,4-diamine
CID 80821177
3-[(4-amino-6-ethoxy-1,3,5-triazin-2-yl)-(2-methoxyethyl)amino]propanenitrile
CID 80829691
2-N-[2-(cyclopropylmethoxy)ethyl]-6-ethoxy-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 80851949
2-N-butan-2-yl-4-N,4-N-diethyl-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4,6-triamine
CID 80787377
2-N-(1-cyclopropylethyl)-6-methoxy-2-N-(2-methoxyethyl)pyridine-2,5-diamine
CID 55004688
6-ethoxy-2-N-methyl-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80776108
2-N-(2-methoxyethyl)-2-N-methyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80795309
6-ethoxy-2-N-methyl-2-N-(4-methylpentan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80810648
2-N-cyclopropyl-2-N-(cyclopropylmethyl)-6-ethoxy-1,3,5-triazine-2,4-diamine
CID 80845232
5-N-(1-cyclopropylethyl)-1-ethyl-5-N-(2-methoxyethyl)-3-methylpyrazole-4,5-diamine
CID 66012447
6-ethoxy-2-N-methyl-2-N-pentan-3-yl-1,3,5-triazine-2,4-diamine
CID 80792073

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine (CID 80820940) is 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine is CCOc1nc(N)nc(N(CCOC)C(C)C2CC2)n1.
What is the InChIKey of 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is UXIOKYRKASNQHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O2/c1-4-20-13-16-11(14)15-12(17-13)18(7-8-19-3)9(2)10-5-6-10/h9-10H,4-8H2,1-3H3,(H2,14,15,16,17).
What are the key properties of 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine?
2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 281.36 g/mol, XLogP of 1.10, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-cyclopropylethyl)-6-ethoxy-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80820940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).