N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide

C8H10N4O3 — CID 16960192

IUPACN-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide
SMILESCNC(=O)CNc1ccc([N+](=O)[O-])cn1
InChIInChI=1S/C8H10N4O3/c1-9-8(13)5-11-7-3-2-6(4-10-7)12(14)15/h2-4H,5H2,1H3,(H,9,13)(H,10,11)
InChIKeyQYIYDBYHVCIGKG-UHFFFAOYSA-N
MW210.19 g/mol
LogP0.15
Rot. Bonds4

About N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide

N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide (PubChem CID 16960192) has the molecular formula C8H10N4O3 and a molecular weight of 210.19 g/mol. Its IUPAC name is N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide
PubChem CID16960192
Molecular FormulaC8H10N4O3
Molecular Weight210.19 g/mol
Exact Mass210.08
IUPAC NameN-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide
SMILESCNC(=O)CNc1ccc([N+](=O)[O-])cn1
InChIInChI=1S/C8H10N4O3/c1-9-8(13)5-11-7-3-2-6(4-10-7)12(14)15/h2-4H,5H2,1H3,(H,9,13)(H,10,11)
InChIKeyQYIYDBYHVCIGKG-UHFFFAOYSA-N
XLogP0.15
TPSA97.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[(5-nitro-2-pyridinyl)amino]acetic acid
CID 3798682
N-(2-aminoethyl)-2-[(5-nitro-2-pyridinyl)amino]acetamide
CID 39161951
3-methyl-2-[[2-[(5-nitro-2-pyridinyl)amino]acetyl]amino]butanoic acid
CID 82032786
4-[[2-[(5-nitro-2-pyridinyl)amino]acetyl]amino]butanoic acid
CID 39186323
N-(4-bromo-2-methylphenyl)-2-[(5-nitro-2-pyridinyl)amino]acetamide
CID 32680618
N-(2,2-dimethylpropyl)-5-nitropyridin-2-amine
CID 59380857
3-[[(5-nitro-2-pyridinyl)amino]methyl]pentan-3-ol
CID 62059734
N,2-dimethyl-N'-(5-nitro-2-pyridinyl)propane-1,3-diamine
CID 115303127
N-methyl-2-[4-[(5-nitro-2-pyridinyl)amino]piperidin-1-yl]acetamide
CID 32884003
N-methyl-2-[(5-nitro-2-pyridinyl)amino]ethanesulfonamide
CID 102675378
N-butan-2-yl-3-[(5-nitro-2-pyridinyl)amino]propanamide
CID 47282818
N'-(5-nitro-2-pyridinyl)ethane-1,2-diamine;hydrochloride
CID 141044426

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide?
The IUPAC name of N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide (CID 16960192) is N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide.
What is the SMILES notation for N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide?
The canonical SMILES for N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide is CNC(=O)CNc1ccc([N+](=O)[O-])cn1.
What is the InChIKey of N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide?
The InChIKey is QYIYDBYHVCIGKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O3/c1-9-8(13)5-11-7-3-2-6(4-10-7)12(14)15/h2-4H,5H2,1H3,(H,9,13)(H,10,11).
What are the key properties of N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide?
N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide has a molecular weight of 210.19 g/mol, XLogP of 0.15, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[(5-nitro-2-pyridinyl)amino]acetamide is sourced from PubChem (CID 16960192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).