2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine

C14H19N7 — CID 146077498

IUPAC2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine
SMILESCN1CCc2ncnc(N3Cc4nn(C)c(N)c4C3)c2C1
InChIInChI=1S/C14H19N7/c1-19-4-3-11-10(5-19)14(17-8-16-11)21-6-9-12(7-21)18-20(2)13(9)15/h8H,3-7,15H2,1-2H3
InChIKeyLNADOZUESPJMDL-UHFFFAOYSA-N
MW285.35 g/mol
LogP0.30
Rot. Bonds1

About 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine

2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine (PubChem CID 146077498) has the molecular formula C14H19N7 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine.

Molecular Properties

Compound Name2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine
PubChem CID146077498
Molecular FormulaC14H19N7
Molecular Weight285.35 g/mol
Exact Mass285.17
IUPAC Name2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine
SMILESCN1CCc2ncnc(N3Cc4nn(C)c(N)c4C3)c2C1
InChIInChI=1S/C14H19N7/c1-19-4-3-11-10(5-19)14(17-8-16-11)21-6-9-12(7-21)18-20(2)13(9)15/h8H,3-7,15H2,1-2H3
InChIKeyLNADOZUESPJMDL-UHFFFAOYSA-N
XLogP0.30
TPSA76.10 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine?
The IUPAC name of 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine (CID 146077498) is 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine.
What is the SMILES notation for 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine?
The canonical SMILES for 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine is CN1CCc2ncnc(N3Cc4nn(C)c(N)c4C3)c2C1.
What is the InChIKey of 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine?
The InChIKey is LNADOZUESPJMDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N7/c1-19-4-3-11-10(5-19)14(17-8-16-11)21-6-9-12(7-21)18-20(2)13(9)15/h8H,3-7,15H2,1-2H3.
What are the key properties of 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine?
2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine has a molecular weight of 285.35 g/mol, XLogP of 0.30, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(6-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)-4,6-dihydropyrrolo[3,4-c]pyrazol-3-amine is sourced from PubChem (CID 146077498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).