N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine

C13H23N5O — CID 80790959

IUPACN-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCCNc1nc(OC(C)C)nc(N2CCCC2C)n1
InChIInChI=1S/C13H23N5O/c1-5-14-11-15-12(18-8-6-7-10(18)4)17-13(16-11)19-9(2)3/h9-10H,5-8H2,1-4H3,(H,14,15,16,17)
InChIKeyIOABSWSAVIECJZ-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.08
Rot. Bonds5

About N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine

N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 80790959) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID80790959
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC NameN-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCCNc1nc(OC(C)C)nc(N2CCCC2C)n1
InChIInChI=1S/C13H23N5O/c1-5-14-11-15-12(18-8-6-7-10(18)4)17-13(16-11)19-9(2)3/h9-10H,5-8H2,1-4H3,(H,14,15,16,17)
InChIKeyIOABSWSAVIECJZ-UHFFFAOYSA-N
XLogP2.08
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine with MolForge

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Related Compounds

[1-[4-(ethylamino)-6-propan-2-yloxy-1,3,5-triazin-2-yl]pyrrolidin-2-yl]methanol
CID 80794942
N-ethyl-4-(2-methylazepan-1-yl)-6-propoxy-1,3,5-triazin-2-amine
CID 80821345
4-(2,6-dimethylmorpholin-4-yl)-N-ethyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80749448
2-N-cyclobutyl-4-N-ethyl-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80826015
4-N-ethyl-6-propan-2-yloxy-2-N-(2-pyrrolidin-1-ylethyl)-1,3,5-triazine-2,4-diamine
CID 80803986
1-[4-propan-2-yloxy-6-(propylamino)-1,3,5-triazin-2-yl]piperidin-3-ol
CID 80771712
4-(cyclopropylmethoxy)-N-ethyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80865601
N-ethyl-4-(3-methylcyclohexyl)oxy-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80844565
N-ethyl-4-(2-ethylazepan-1-yl)-6-methoxy-1,3,5-triazin-2-amine
CID 104693031
4-ethoxy-N-ethyl-6-(2-ethylpiperidin-1-yl)-1,3,5-triazin-2-amine
CID 80776425
4-N-ethyl-2-N-(oxan-4-ylmethyl)-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80818729
[4-methoxy-6-(2-methylpiperidin-1-yl)-1,3,5-triazin-2-yl]hydrazine
CID 80927925

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 80790959) is N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine is CCNc1nc(OC(C)C)nc(N2CCCC2C)n1.
What is the InChIKey of N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is IOABSWSAVIECJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-5-14-11-15-12(18-8-6-7-10(18)4)17-13(16-11)19-9(2)3/h9-10H,5-8H2,1-4H3,(H,14,15,16,17).
What are the key properties of N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine?
N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 265.36 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-methylpyrrolidin-1-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80790959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).