6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine

C11H20N6O — CID 80800739

IUPAC6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(N)nc(NC(C)CN2CCCC2)n1
InChIInChI=1S/C11H20N6O/c1-8(7-17-5-3-4-6-17)13-10-14-9(12)15-11(16-10)18-2/h8H,3-7H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyGNQFLDAUGGORLF-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.36
Rot. Bonds5

About 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine

6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine (PubChem CID 80800739) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
PubChem CID80800739
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(N)nc(NC(C)CN2CCCC2)n1
InChIInChI=1S/C11H20N6O/c1-8(7-17-5-3-4-6-17)13-10-14-9(12)15-11(16-10)18-2/h8H,3-7H2,1-2H3,(H3,12,13,14,15,16)
InChIKeyGNQFLDAUGGORLF-UHFFFAOYSA-N
XLogP0.36
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,6-dimethoxy-N-(1-morpholin-4-ylpropan-2-yl)-1,3,5-triazin-2-amine
CID 62861950
6-ethoxy-4-N-methyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80800577
4-methoxy-6-methyl-N-(1-piperidin-1-ylpropan-2-yl)pyrimidin-2-amine
CID 112691746
2-[(4-amino-6-methoxy-1,3,5-triazin-2-yl)amino]propane-1,3-diol
CID 80842933
6-hydrazinyl-4-N,4-N-dimethyl-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80896860
6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridine-2,3-diamine
CID 115320544
2-N-(1-ethylpiperidin-3-yl)-6-methoxy-1,3,5-triazine-2,4-diamine
CID 80800686
6-chloro-4-N-methyl-2-N-(1-piperidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80801538
3-N-(4,6-dimethoxy-1,3,5-triazin-2-yl)butane-1,3-diamine
CID 83178530
6-propan-2-yloxy-2-N-(3-pyrrolidin-1-ylpropyl)-1,3,5-triazine-2,4-diamine
CID 80830703
2-N-(2,3-dimethylbutyl)-6-methoxy-1,3,5-triazine-2,4-diamine
CID 80844381
2-N-(4-methylhexan-2-yl)-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80829230

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine (CID 80800739) is 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine is COc1nc(N)nc(NC(C)CN2CCCC2)n1.
What is the InChIKey of 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine?
The InChIKey is GNQFLDAUGGORLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-8(7-17-5-3-4-6-17)13-10-14-9(12)15-11(16-10)18-2/h8H,3-7H2,1-2H3,(H3,12,13,14,15,16).
What are the key properties of 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine?
6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine has a molecular weight of 252.32 g/mol, XLogP of 0.36, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(1-pyrrolidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80800739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).