4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one

C24H30N8O — CID 167495222

IUPAC4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one
SMILESCNCc1nc(N(C)C(C)C)cc2c1CN(c1cccc(-c3cnc4n3CCNC4)n1)C2=O
InChIInChI=1S/C24H30N8O/c1-15(2)30(4)22-10-16-17(19(29-22)11-25-3)14-32(24(16)33)21-7-5-6-18(28-21)20-12-27-23-13-26-8-9-31(20)23/h5-7,10,12,15,25-26H,8-9,11,13-14H2,1-4H3
InChIKeySKYGJODVNXWMOL-UHFFFAOYSA-N
MW446.56 g/mol
LogP2.17
Rot. Bonds6

About 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one

4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one (PubChem CID 167495222) has the molecular formula C24H30N8O and a molecular weight of 446.56 g/mol. Its IUPAC name is 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one.

Molecular Properties

Compound Name4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one
PubChem CID167495222
Molecular FormulaC24H30N8O
Molecular Weight446.56 g/mol
Exact Mass446.25
IUPAC Name4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one
SMILESCNCc1nc(N(C)C(C)C)cc2c1CN(c1cccc(-c3cnc4n3CCNC4)n1)C2=O
InChIInChI=1S/C24H30N8O/c1-15(2)30(4)22-10-16-17(19(29-22)11-25-3)14-32(24(16)33)21-7-5-6-18(28-21)20-12-27-23-13-26-8-9-31(20)23/h5-7,10,12,15,25-26H,8-9,11,13-14H2,1-4H3
InChIKeySKYGJODVNXWMOL-UHFFFAOYSA-N
XLogP2.17
TPSA91.21 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.56
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one?
The IUPAC name of 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one (CID 167495222) is 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one.
What is the SMILES notation for 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one?
The canonical SMILES for 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one is CNCc1nc(N(C)C(C)C)cc2c1CN(c1cccc(-c3cnc4n3CCNC4)n1)C2=O.
What is the InChIKey of 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one?
The InChIKey is SKYGJODVNXWMOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N8O/c1-15(2)30(4)22-10-16-17(19(29-22)11-25-3)14-32(24(16)33)21-7-5-6-18(28-21)20-12-27-23-13-26-8-9-31(20)23/h5-7,10,12,15,25-26H,8-9,11,13-14H2,1-4H3.
What are the key properties of 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one?
4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one has a molecular weight of 446.56 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methylaminomethyl)-6-[methyl(propan-2-yl)amino]-2-[6-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-3-yl)-2-pyridinyl]-3H-pyrrolo[3,4-c]pyridin-1-one is sourced from PubChem (CID 167495222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).