N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide

C19H26N4O2 — CID 126799109

IUPACN-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide
SMILESCCNC(=O)CC1CCCCN1Cc1cc(=O)n2c(C)cccc2n1
InChIInChI=1S/C19H26N4O2/c1-3-20-18(24)12-16-8-4-5-10-22(16)13-15-11-19(25)23-14(2)7-6-9-17(23)21-15/h6-7,9,11,16H,3-5,8,10,12-13H2,1-2H3,(H,20,24)
InChIKeyOSJZHNUSBORTFU-UHFFFAOYSA-N
MW342.44 g/mol
LogP1.88
Rot. Bonds5

About N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide

N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide (PubChem CID 126799109) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide
PubChem CID126799109
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide
SMILESCCNC(=O)CC1CCCCN1Cc1cc(=O)n2c(C)cccc2n1
InChIInChI=1S/C19H26N4O2/c1-3-20-18(24)12-16-8-4-5-10-22(16)13-15-11-19(25)23-14(2)7-6-9-17(23)21-15/h6-7,9,11,16H,3-5,8,10,12-13H2,1-2H3,(H,20,24)
InChIKeyOSJZHNUSBORTFU-UHFFFAOYSA-N
XLogP1.88
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide?
The IUPAC name of N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide (CID 126799109) is N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide.
What is the SMILES notation for N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide?
The canonical SMILES for N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide is CCNC(=O)CC1CCCCN1Cc1cc(=O)n2c(C)cccc2n1.
What is the InChIKey of N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide?
The InChIKey is OSJZHNUSBORTFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-3-20-18(24)12-16-8-4-5-10-22(16)13-15-11-19(25)23-14(2)7-6-9-17(23)21-15/h6-7,9,11,16H,3-5,8,10,12-13H2,1-2H3,(H,20,24).
What are the key properties of N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide?
N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide has a molecular weight of 342.44 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[1-[(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidin-2-yl]acetamide is sourced from PubChem (CID 126799109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).