2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

C15H25N5O — CID 139682445

IUPAC2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
SMILESCCCN(CCC)c1nc2n(CCC)c(=O)c(C)cn2n1
InChIInChI=1S/C15H25N5O/c1-5-8-18(9-6-2)14-16-15-19(10-7-3)13(21)12(4)11-20(15)17-14/h11H,5-10H2,1-4H3
InChIKeySPFVLBXBZZIAFJ-UHFFFAOYSA-N
MW291.40 g/mol
LogP2.24
Rot. Bonds7

About 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one

2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one (PubChem CID 139682445) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one.

Molecular Properties

Compound Name2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
PubChem CID139682445
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC Name2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one
SMILESCCCN(CCC)c1nc2n(CCC)c(=O)c(C)cn2n1
InChIInChI=1S/C15H25N5O/c1-5-8-18(9-6-2)14-16-15-19(10-7-3)13(21)12(4)11-20(15)17-14/h11H,5-10H2,1-4H3
InChIKeySPFVLBXBZZIAFJ-UHFFFAOYSA-N
XLogP2.24
TPSA55.43 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one?
The IUPAC name of 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one (CID 139682445) is 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one.
What is the SMILES notation for 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one?
The canonical SMILES for 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one is CCCN(CCC)c1nc2n(CCC)c(=O)c(C)cn2n1.
What is the InChIKey of 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one?
The InChIKey is SPFVLBXBZZIAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-5-8-18(9-6-2)14-16-15-19(10-7-3)13(21)12(4)11-20(15)17-14/h11H,5-10H2,1-4H3.
What are the key properties of 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one?
2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one has a molecular weight of 291.40 g/mol, XLogP of 2.24, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dipropylamino)-6-methyl-4-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-5-one is sourced from PubChem (CID 139682445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).