7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one

C15H17N3O — CID 25190888

IUPAC7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
SMILESCC(C)C1CNC(=O)c2cc(-c3ccncc3)[nH]c21
InChIInChI=1S/C15H17N3O/c1-9(2)12-8-17-15(19)11-7-13(18-14(11)12)10-3-5-16-6-4-10/h3-7,9,12,18H,8H2,1-2H3,(H,17,19)
InChIKeyDAENWNUTCUORJB-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.56
Rot. Bonds2

About 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one

7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one (PubChem CID 25190888) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
PubChem CID25190888
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one
SMILESCC(C)C1CNC(=O)c2cc(-c3ccncc3)[nH]c21
InChIInChI=1S/C15H17N3O/c1-9(2)12-8-17-15(19)11-7-13(18-14(11)12)10-3-5-16-6-4-10/h3-7,9,12,18H,8H2,1-2H3,(H,17,19)
InChIKeyDAENWNUTCUORJB-UHFFFAOYSA-N
XLogP2.56
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one?
The IUPAC name of 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one (CID 25190888) is 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one.
What is the SMILES notation for 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one?
The canonical SMILES for 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one is CC(C)C1CNC(=O)c2cc(-c3ccncc3)[nH]c21.
What is the InChIKey of 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one?
The InChIKey is DAENWNUTCUORJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-9(2)12-8-17-15(19)11-7-13(18-14(11)12)10-3-5-16-6-4-10/h3-7,9,12,18H,8H2,1-2H3,(H,17,19).
What are the key properties of 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one?
7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one has a molecular weight of 255.32 g/mol, XLogP of 2.56, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-propan-2-yl-2-pyridin-4-yl-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one is sourced from PubChem (CID 25190888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).