2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide

C13H18N4O3 — CID 62874653

IUPAC2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)NCC(=O)N1CCNCC1
InChIInChI=1S/C13H18N4O3/c1-20-13-10(3-2-4-15-13)12(19)16-9-11(18)17-7-5-14-6-8-17/h2-4,14H,5-9H2,1H3,(H,16,19)
InChIKeyFUMSTPWGPVXFRR-UHFFFAOYSA-N
MW278.31 g/mol
LogP-0.75
Rot. Bonds4

About 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide

2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide (PubChem CID 62874653) has the molecular formula C13H18N4O3 and a molecular weight of 278.31 g/mol. Its IUPAC name is 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide
PubChem CID62874653
Molecular FormulaC13H18N4O3
Molecular Weight278.31 g/mol
Exact Mass278.14
IUPAC Name2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide
SMILESCOc1ncccc1C(=O)NCC(=O)N1CCNCC1
InChIInChI=1S/C13H18N4O3/c1-20-13-10(3-2-4-15-13)12(19)16-9-11(18)17-7-5-14-6-8-17/h2-4,14H,5-9H2,1H3,(H,16,19)
InChIKeyFUMSTPWGPVXFRR-UHFFFAOYSA-N
XLogP-0.75
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 5-0.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]pyridine-3-carboxamide
CID 60598831
2-methoxy-N-(3-piperazin-1-ylpropyl)pyridine-3-carboxamide
CID 62874313
2-methyl-N-(2-oxo-2-piperazin-1-ylethyl)benzamide
CID 28708758
2-chloro-N-(2-oxo-2-piperazin-1-ylethyl)benzamide
CID 28708781
N-(2-hydroxy-2-methylpropyl)-2-methoxypyridine-3-carboxamide
CID 65109453
2-methoxy-N-(3-piperidin-4-yloxypropyl)pyridine-3-carboxamide
CID 63869445
N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide
CID 61174926
2-methoxy-N-(pyrrolidin-2-ylmethyl)pyridine-3-carboxamide
CID 55126271
N-(3-bromo-2,2-dimethylpropyl)-2-methoxypyridine-3-carboxamide
CID 115364804
[4-(azetidin-3-yl)piperazin-1-yl]-(2-methoxy-3-pyridinyl)methanone
CID 66201560
N-(3-chloropropyl)-2-methoxypyridine-3-carboxamide
CID 62873972
2-[(3-methyl-2-pyridinyl)amino]-1-piperazin-1-ylethanone
CID 62255323

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide (CID 62874653) is 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide is COc1ncccc1C(=O)NCC(=O)N1CCNCC1.
What is the InChIKey of 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide?
The InChIKey is FUMSTPWGPVXFRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O3/c1-20-13-10(3-2-4-15-13)12(19)16-9-11(18)17-7-5-14-6-8-17/h2-4,14H,5-9H2,1H3,(H,16,19).
What are the key properties of 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide?
2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide has a molecular weight of 278.31 g/mol, XLogP of -0.75, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-oxo-2-piperazin-1-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 62874653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).