(2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide

C15H18N4O2 — CID 91829297

IUPAC(2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide
SMILESCc1cccc2nc(CN3CCC[C@@H]3C(N)=O)cc(=O)n12
InChIInChI=1S/C15H18N4O2/c1-10-4-2-6-13-17-11(8-14(20)19(10)13)9-18-7-3-5-12(18)15(16)21/h2,4,6,8,12H,3,5,7,9H2,1H3,(H2,16,21)/t12-/m1/s1
InChIKeyXZJDKCWZBXZLQV-GFCCVEGCSA-N
MW286.33 g/mol
LogP0.45
Rot. Bonds3

About (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide

(2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide (PubChem CID 91829297) has the molecular formula C15H18N4O2 and a molecular weight of 286.33 g/mol. Its IUPAC name is (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide
PubChem CID91829297
Molecular FormulaC15H18N4O2
Molecular Weight286.33 g/mol
Exact Mass286.14
IUPAC Name(2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide
SMILESCc1cccc2nc(CN3CCC[C@@H]3C(N)=O)cc(=O)n12
InChIInChI=1S/C15H18N4O2/c1-10-4-2-6-13-17-11(8-14(20)19(10)13)9-18-7-3-5-12(18)15(16)21/h2,4,6,8,12H,3,5,7,9H2,1H3,(H2,16,21)/t12-/m1/s1
InChIKeyXZJDKCWZBXZLQV-GFCCVEGCSA-N
XLogP0.45
TPSA80.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide with MolForge

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Related Compounds

N-{2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}pentanamide
CID 7217027
(2S,4R)-4-fluoro-1-(4-oxopyrido[1,2-a]pyrimidin-2-yl)pyrrolidine-2-carboxamide
CID 120928807
(2S,4R)-1-[(4-ethyl-6-oxo-1H-pyrimidin-2-yl)methyl]-4-fluoropyrrolidine-2-carboxamide
CID 137154589
N-(2,8-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)pentanamide
CID 16799382
N-(7-chloro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)pentanamide
CID 18566152
N-(2,9-dimethyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl)pentanamide
CID 18566211
2-[[(5-Oxopyrrolidin-2-yl)methylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 64432596
7-bromo-2-[[[(2S)-5-oxopyrrolidin-2-yl]methylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 156822287
8-bromo-3-methyl-2-[[[(2S)-5-oxopyrrolidin-2-yl]methylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 156822410
2-[[[(2R)-5-oxopyrrolidin-2-yl]methylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 166692610
2-[[[(2S)-5-oxopyrrolidin-2-yl]methylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 166692623
8-Bromo-3-methyl-2-[[(5-oxopyrrolidin-2-yl)methylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 166693434

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide (CID 91829297) is (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide is Cc1cccc2nc(CN3CCC[C@@H]3C(N)=O)cc(=O)n12.
What is the InChIKey of (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is XZJDKCWZBXZLQV-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-10-4-2-6-13-17-11(8-14(20)19(10)13)9-18-7-3-5-12(18)15(16)21/h2,4,6,8,12H,3,5,7,9H2,1H3,(H2,16,21)/t12-/m1/s1.
What are the key properties of (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide?
(2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 286.33 g/mol, XLogP of 0.45, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 91829297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).