N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide

C12H14N4O3 — CID 81257251

IUPACN-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide
SMILESCOCCn1cc(NC(=O)n2ccnc2)ccc1=O
InChIInChI=1S/C12H14N4O3/c1-19-7-6-15-8-10(2-3-11(15)17)14-12(18)16-5-4-13-9-16/h2-5,8-9H,6-7H2,1H3,(H,14,18)
InChIKeyKEADOOQUZRKWCS-UHFFFAOYSA-N
MW262.27 g/mol
LogP0.77
Rot. Bonds4

About N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide

N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide (PubChem CID 81257251) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide.

Molecular Properties

Compound NameN-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide
PubChem CID81257251
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC NameN-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide
SMILESCOCCn1cc(NC(=O)n2ccnc2)ccc1=O
InChIInChI=1S/C12H14N4O3/c1-19-7-6-15-8-10(2-3-11(15)17)14-12(18)16-5-4-13-9-16/h2-5,8-9H,6-7H2,1H3,(H,14,18)
InChIKeyKEADOOQUZRKWCS-UHFFFAOYSA-N
XLogP0.77
TPSA78.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(2-methoxyethyl)pyrazol-4-yl]imidazole-1-carboxamide
CID 81257970
N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-3-methylbut-2-enamide
CID 113222064
3-chloro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]pyridine-4-carboxamide
CID 66483724
2-amino-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide
CID 43713286
2-bromo-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]propanamide
CID 107903976
2-(2-methoxyethylamino)-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]acetamide
CID 79281498
3-chloro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-2,2-dimethylpropanamide
CID 63680566
2-fluoro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]pyridine-4-carboxamide
CID 61294942
N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]-2-methyl-3-(methylamino)propanamide
CID 79196697
4-chloro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]butanamide
CID 63307515
5-hydroxy-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]pentanamide
CID 79199757
2-fluoro-N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]benzamide
CID 38675455

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide?
The IUPAC name of N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide (CID 81257251) is N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide.
What is the SMILES notation for N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide?
The canonical SMILES for N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide is COCCn1cc(NC(=O)n2ccnc2)ccc1=O.
What is the InChIKey of N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide?
The InChIKey is KEADOOQUZRKWCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O3/c1-19-7-6-15-8-10(2-3-11(15)17)14-12(18)16-5-4-13-9-16/h2-5,8-9H,6-7H2,1H3,(H,14,18).
What are the key properties of N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide?
N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide has a molecular weight of 262.27 g/mol, XLogP of 0.77, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methoxyethyl)-6-oxo-3-pyridinyl]imidazole-1-carboxamide is sourced from PubChem (CID 81257251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).