6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one

C14H15N3O — CID 25190885

IUPAC6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one
SMILESCC1(C)Cc2[nH]c(-c3ccncc3)cc2C(=O)N1
InChIInChI=1S/C14H15N3O/c1-14(2)8-12-10(13(18)17-14)7-11(16-12)9-3-5-15-6-4-9/h3-7,16H,8H2,1-2H3,(H,17,18)
InChIKeyRDFLEVCRRDMGGW-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.14
Rot. Bonds1

About 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one

6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one (PubChem CID 25190885) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one
PubChem CID25190885
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one
SMILESCC1(C)Cc2[nH]c(-c3ccncc3)cc2C(=O)N1
InChIInChI=1S/C14H15N3O/c1-14(2)8-12-10(13(18)17-14)7-11(16-12)9-3-5-15-6-4-9/h3-7,16H,8H2,1-2H3,(H,17,18)
InChIKeyRDFLEVCRRDMGGW-UHFFFAOYSA-N
XLogP2.14
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one?
The IUPAC name of 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one (CID 25190885) is 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one.
What is the SMILES notation for 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one?
The canonical SMILES for 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one is CC1(C)Cc2[nH]c(-c3ccncc3)cc2C(=O)N1.
What is the InChIKey of 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one?
The InChIKey is RDFLEVCRRDMGGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-14(2)8-12-10(13(18)17-14)7-11(16-12)9-3-5-15-6-4-9/h3-7,16H,8H2,1-2H3,(H,17,18).
What are the key properties of 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one?
6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one has a molecular weight of 241.29 g/mol, XLogP of 2.14, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethyl-2-pyridin-4-yl-5,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4-one is sourced from PubChem (CID 25190885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).