6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one

C14H15N3O2 — CID 3079297

IUPAC6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one
SMILESCc1cccc2ncc(C(=O)N3CCCC3)c(=O)n12
InChIInChI=1S/C14H15N3O2/c1-10-5-4-6-12-15-9-11(14(19)17(10)12)13(18)16-7-2-3-8-16/h4-6,9H,2-3,7-8H2,1H3
InChIKeyNRNDGOPSXXHRLY-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.24
Rot. Bonds1

About 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one

6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one (PubChem CID 3079297) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one
PubChem CID3079297
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one
SMILESCc1cccc2ncc(C(=O)N3CCCC3)c(=O)n12
InChIInChI=1S/C14H15N3O2/c1-10-5-4-6-12-15-9-11(14(19)17(10)12)13(18)16-7-2-3-8-16/h4-6,9H,2-3,7-8H2,1H3
InChIKeyNRNDGOPSXXHRLY-UHFFFAOYSA-N
XLogP1.24
TPSA54.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one?
The IUPAC name of 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one (CID 3079297) is 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one?
The canonical SMILES for 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one is Cc1cccc2ncc(C(=O)N3CCCC3)c(=O)n12.
What is the InChIKey of 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one?
The InChIKey is NRNDGOPSXXHRLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-10-5-4-6-12-15-9-11(14(19)17(10)12)13(18)16-7-2-3-8-16/h4-6,9H,2-3,7-8H2,1H3.
What are the key properties of 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one?
6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one has a molecular weight of 257.29 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(pyrrolidine-1-carbonyl)pyrido[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 3079297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).