N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide

C12H14N4O3 — CID 154671440

IUPACN-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide
SMILESCn1cccc/c1=N/N(C=O)C1CCC(=O)NC1=O
InChIInChI=1S/C12H14N4O3/c1-15-7-3-2-4-10(15)14-16(8-17)9-5-6-11(18)13-12(9)19/h2-4,7-9H,5-6H2,1H3,(H,13,18,19)/b14-10-
InChIKeyFQXZKQRTQFGBKV-UVTDQMKNSA-N
MW262.27 g/mol
LogP-0.90
Rot. Bonds3

About N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide

N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide (PubChem CID 154671440) has the molecular formula C12H14N4O3 and a molecular weight of 262.27 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide
PubChem CID154671440
Molecular FormulaC12H14N4O3
Molecular Weight262.27 g/mol
Exact Mass262.11
IUPAC NameN-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide
SMILESCn1cccc/c1=N/N(C=O)C1CCC(=O)NC1=O
InChIInChI=1S/C12H14N4O3/c1-15-7-3-2-4-10(15)14-16(8-17)9-5-6-11(18)13-12(9)19/h2-4,7-9H,5-6H2,1H3,(H,13,18,19)/b14-10-
InChIKeyFQXZKQRTQFGBKV-UVTDQMKNSA-N
XLogP-0.90
TPSA83.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 5-0.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide (CID 154671440) is N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide is Cn1cccc/c1=N/N(C=O)C1CCC(=O)NC1=O.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide?
The InChIKey is FQXZKQRTQFGBKV-UVTDQMKNSA-N. The full InChI is InChI=1S/C12H14N4O3/c1-15-7-3-2-4-10(15)14-16(8-17)9-5-6-11(18)13-12(9)19/h2-4,7-9H,5-6H2,1H3,(H,13,18,19)/b14-10-.
What are the key properties of N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide?
N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide has a molecular weight of 262.27 g/mol, XLogP of -0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)-N-[(Z)-(1-methyl-2-pyridinylidene)amino]formamide is sourced from PubChem (CID 154671440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).