N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide

C10H10N4O3 — CID 6502102

IUPACN-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide
SMILESO=C1CCN(NC(=O)c2cccnc2)C(=O)N1
InChIInChI=1S/C10H10N4O3/c15-8-3-5-14(10(17)12-8)13-9(16)7-2-1-4-11-6-7/h1-2,4,6H,3,5H2,(H,13,16)(H,12,15,17)
InChIKeyZYSRALGTZPOMAX-UHFFFAOYSA-N
MW234.22 g/mol
LogP-0.33
Rot. Bonds2

About N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide

N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide (PubChem CID 6502102) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide
PubChem CID6502102
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC NameN-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide
SMILESO=C1CCN(NC(=O)c2cccnc2)C(=O)N1
InChIInChI=1S/C10H10N4O3/c15-8-3-5-14(10(17)12-8)13-9(16)7-2-1-4-11-6-7/h1-2,4,6H,3,5H2,(H,13,16)(H,12,15,17)
InChIKeyZYSRALGTZPOMAX-UHFFFAOYSA-N
XLogP-0.33
TPSA91.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-oxopyrrolidin-2-yl)methyl]pyridine-3-carboxamide
CID 110732294
N-methylpyridine-3-carboxamide chloride
CID 20976730
N-(4-oxo-3,5-dihydro-2H-1,5-benzoxazepin-7-yl)pyridine-3-carboxamide
CID 110778271
trimethyl-(pyridine-3-carbonylamino)azanium
CID 177120197
N-[(1S,2R,6S,7R,8S,10S)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]pyridine-3-carboxamide
CID 98051227
N-[(1S,2R,6R,7S,8R,10R)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]pyridine-3-carboxamide
CID 124754934
N-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]pyridine-3-carboxamide
CID 166179612
N-(4-methyl-1-propan-2-ylpiperidin-4-yl)pyridine-3-carboxamide
CID 134505678
N-[(15S,19S)-16,18-dioxo-17-azapentacyclo[6.6.5.02,7.09,14.015,19]nonadeca-2,4,6,9,11,13-hexaen-17-yl]pyridine-3-carboxamide
CID 1107922
1-(pyridine-3-carbonyl)imidazolidin-2-one
CID 57266793
S-(2-oxoazetidin-1-yl) pyridine-3-carbothioate
CID 158660231
N-[4-(2,3-dihydroxypropyl)piperazin-1-yl]pyridine-3-carboxamide
CID 67862274

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide (CID 6502102) is N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide is O=C1CCN(NC(=O)c2cccnc2)C(=O)N1.
What is the InChIKey of N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide?
The InChIKey is ZYSRALGTZPOMAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c15-8-3-5-14(10(17)12-8)13-9(16)7-2-1-4-11-6-7/h1-2,4,6H,3,5H2,(H,13,16)(H,12,15,17).
What are the key properties of N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide?
N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide has a molecular weight of 234.22 g/mol, XLogP of -0.33, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dioxo-1,3-diazinan-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 6502102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).