methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate

C15H20N4O2 — CID 62026541

IUPACmethyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate
SMILESCOC(=O)C1CCCN1Cc1cn2c(C)cc(C)nc2n1
InChIInChI=1S/C15H20N4O2/c1-10-7-11(2)19-9-12(17-15(19)16-10)8-18-6-4-5-13(18)14(20)21-3/h7,9,13H,4-6,8H2,1-3H3
InChIKeyAYYIWDGPRHXHFT-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.48
Rot. Bonds3

About methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate

methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate (PubChem CID 62026541) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate.

Molecular Properties

Compound Namemethyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate
PubChem CID62026541
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Namemethyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate
SMILESCOC(=O)C1CCCN1Cc1cn2c(C)cc(C)nc2n1
InChIInChI=1S/C15H20N4O2/c1-10-7-11(2)19-9-12(17-15(19)16-10)8-18-6-4-5-13(18)14(20)21-3/h7,9,13H,4-6,8H2,1-3H3
InChIKeyAYYIWDGPRHXHFT-UHFFFAOYSA-N
XLogP1.48
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

[1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidin-2-yl]methanamine
CID 115312884
[1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-3-methylpyrrolidin-2-yl]methanol
CID 102789047
methyl 1-[[4-(ethylamino)-6-methylpyrimidin-2-yl]methyl]pyrrolidine-2-carboxylate
CID 80657147
methyl 1-[2-(3,5-dimethylpyrazol-1-yl)ethyl]pyrrolidine-2-carboxylate
CID 56790676
5-[(2R)-1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]-N,1-dimethylpyrrole-2-carboxamide
CID 129333242
1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-methylpiperidin-3-amine
CID 62545800
5,7-dimethyl-2-(pyrrolidin-1-ylmethyl)imidazo[1,2-a]pyrimidine
CID 23910306
methyl 1-[(2-methylquinolin-4-yl)methyl]pyrrolidine-2-carboxylate
CID 78995219
methyl 1-[(6-methylimidazo[1,2-a]pyridin-2-yl)methyl]piperidine-2-carboxylate
CID 78915575
methyl 1-(imidazo[1,2-a]pyridin-2-ylmethyl)pyrrolidine-2-carboxylate
CID 62025948
5,7-dimethyl-2-[[(2S)-2-(1,2,4-triazol-1-ylmethyl)pyrrolidin-1-yl]methyl]imidazo[1,2-a]pyrimidine
CID 95290133
(3R)-1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidin-3-ol
CID 112734197

Frequently Asked Questions

What is the IUPAC name of methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate?
The IUPAC name of methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate (CID 62026541) is methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate.
What is the SMILES notation for methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate?
The canonical SMILES for methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate is COC(=O)C1CCCN1Cc1cn2c(C)cc(C)nc2n1.
What is the InChIKey of methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate?
The InChIKey is AYYIWDGPRHXHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-10-7-11(2)19-9-12(17-15(19)16-10)8-18-6-4-5-13(18)14(20)21-3/h7,9,13H,4-6,8H2,1-3H3.
What are the key properties of methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate?
methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate has a molecular weight of 288.35 g/mol, XLogP of 1.48, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-[(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl]pyrrolidine-2-carboxylate is sourced from PubChem (CID 62026541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).