2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine

C10H19N7 — CID 69320907

IUPAC2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN1CCCC1N(C)c1nc(N)nc(N)n1
InChIInChI=1S/C10H19N7/c1-3-17-6-4-5-7(17)16(2)10-14-8(11)13-9(12)15-10/h7H,3-6H2,1-2H3,(H4,11,12,13,14,15)
InChIKeyZQNOFJPEBLBLJK-UHFFFAOYSA-N
MW237.31 g/mol
LogP-0.09
Rot. Bonds3

About 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine

2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 69320907) has the molecular formula C10H19N7 and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine
PubChem CID69320907
Molecular FormulaC10H19N7
Molecular Weight237.31 g/mol
Exact Mass237.17
IUPAC Name2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine
SMILESCCN1CCCC1N(C)c1nc(N)nc(N)n1
InChIInChI=1S/C10H19N7/c1-3-17-6-4-5-7(17)16(2)10-14-8(11)13-9(12)15-10/h7H,3-6H2,1-2H3,(H4,11,12,13,14,15)
InChIKeyZQNOFJPEBLBLJK-UHFFFAOYSA-N
XLogP-0.09
TPSA97.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-(1-Methylhydrazino)-4,6-di(1-pyrrolidinyl)-1,3,5-triazine
CID 677265
(4,6-Dipyrrolidinyl(1,3,5-triazin-2-yl))propylamine
CID 3158873
tert-Butyl-(4,6-di-pyrrolidin-1-yl-[1,3,5]triazin-2-yl)-amine
CID 974630
N-tert-Butyl-N'-ethyl-6-pyrrolidin-1-yl-[1,3,5]triazine-2,4-diamine
CID 1096075
s-Triazine, 2,4-bis(dimethylamino)-6-(1-pyrrolidinyl)-
CID 202886
s-Triazine, 2,6-diamino-4-dipropylamino-
CID 121256
s-Triazine, 2,4-diamino-6-(1-pyrrolidinyl)-
CID 200843
(4,6-Dipyrrolidinyl(1,3,5-triazin-2-yl))ethylamine
CID 1096073
AG-F-96600
CID 21818
s-Triazine, 2,4-bis(methylamino)-6-(1-pyrrolidinyl)-
CID 204411
Triazine, 2-amino-4,6-dipyrrolidino-
CID 204416
Triazine, 2-amino-4-methyl-6-pyrrolidino-
CID 207475

Frequently Asked Questions

What is the IUPAC name of 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine (CID 69320907) is 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine is CCN1CCCC1N(C)c1nc(N)nc(N)n1.
What is the InChIKey of 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is ZQNOFJPEBLBLJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N7/c1-3-17-6-4-5-7(17)16(2)10-14-8(11)13-9(12)15-10/h7H,3-6H2,1-2H3,(H4,11,12,13,14,15).
What are the key properties of 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine?
2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 237.31 g/mol, XLogP of -0.09, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(1-ethylpyrrolidin-2-yl)-2-N-methyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 69320907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).