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

C14H24N6O — CID 80771865

IUPAC4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine
SMILESCCCN(c1nc(NC)nc(N2CCOCC2)n1)C1CC1
InChIInChI=1S/C14H24N6O/c1-3-6-20(11-4-5-11)14-17-12(15-2)16-13(18-14)19-7-9-21-10-8-19/h11H,3-10H2,1-2H3,(H,15,16,17,18)
InChIKeyLBTYJDFNJJRZJU-UHFFFAOYSA-N
MW292.39 g/mol
LogP1.13
Rot. Bonds6

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

4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine (PubChem CID 80771865) has the molecular formula C14H24N6O and a molecular weight of 292.39 g/mol. Its IUPAC name is 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine
PubChem CID80771865
Molecular FormulaC14H24N6O
Molecular Weight292.39 g/mol
Exact Mass292.20
IUPAC Name4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine
SMILESCCCN(c1nc(NC)nc(N2CCOCC2)n1)C1CC1
InChIInChI=1S/C14H24N6O/c1-3-6-20(11-4-5-11)14-17-12(15-2)16-13(18-14)19-7-9-21-10-8-19/h11H,3-10H2,1-2H3,(H,15,16,17,18)
InChIKeyLBTYJDFNJJRZJU-UHFFFAOYSA-N
XLogP1.13
TPSA66.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine (CID 80771865) is 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine is CCCN(c1nc(NC)nc(N2CCOCC2)n1)C1CC1.
What is the InChIKey of 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine?
The InChIKey is LBTYJDFNJJRZJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N6O/c1-3-6-20(11-4-5-11)14-17-12(15-2)16-13(18-14)19-7-9-21-10-8-19/h11H,3-10H2,1-2H3,(H,15,16,17,18).
What are the key properties of 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine?
4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine has a molecular weight of 292.39 g/mol, XLogP of 1.13, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopropyl-2-N-methyl-6-morpholin-4-yl-4-N-propyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80771865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).