4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine

C13H24N6O — CID 80793641

IUPAC4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine
SMILESCCC(CC)N(C)c1nc(N)nc(N2CCOCC2)n1
InChIInChI=1S/C13H24N6O/c1-4-10(5-2)18(3)12-15-11(14)16-13(17-12)19-6-8-20-9-7-19/h10H,4-9H2,1-3H3,(H2,14,15,16,17)
InChIKeyVBGOADDGKNPSLD-UHFFFAOYSA-N
MW280.38 g/mol
LogP0.92
Rot. Bonds5

About 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine

4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine (PubChem CID 80793641) has the molecular formula C13H24N6O and a molecular weight of 280.38 g/mol. Its IUPAC name is 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine
PubChem CID80793641
Molecular FormulaC13H24N6O
Molecular Weight280.38 g/mol
Exact Mass280.20
IUPAC Name4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine
SMILESCCC(CC)N(C)c1nc(N)nc(N2CCOCC2)n1
InChIInChI=1S/C13H24N6O/c1-4-10(5-2)18(3)12-15-11(14)16-13(17-12)19-6-8-20-9-7-19/h10H,4-9H2,1-3H3,(H2,14,15,16,17)
InChIKeyVBGOADDGKNPSLD-UHFFFAOYSA-N
XLogP0.92
TPSA80.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

4-N,4-N-dimethyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 27396187
4-N-butyl-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80753907
4-N-methyl-4-N-(2-methylsulfanylethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 112667724
4-N-cyclopentyl-4-N-ethyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80775975
4-morpholin-4-yl-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63868604
4-(azepan-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80764187
4-N-methyl-4-N-(1-methylsulfanylpropan-2-yl)-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
CID 115988805
2-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80770087
2-N-[2-[methyl(propan-2-yl)amino]ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80803084
4-(1-ethoxypropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 103491737
6-(4-butan-2-ylpiperazin-1-yl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80825190
2-N,4-N-dimethyl-4-N-pentan-3-yl-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80792687

Frequently Asked Questions

What is the IUPAC name of 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine (CID 80793641) is 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine is CCC(CC)N(C)c1nc(N)nc(N2CCOCC2)n1.
What is the InChIKey of 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is VBGOADDGKNPSLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6O/c1-4-10(5-2)18(3)12-15-11(14)16-13(17-12)19-6-8-20-9-7-19/h10H,4-9H2,1-3H3,(H2,14,15,16,17).
What are the key properties of 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine?
4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 280.38 g/mol, XLogP of 0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-methyl-6-morpholin-4-yl-4-N-pentan-3-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80793641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).