N',5-dimethoxypyridine-2-carboximidamide

C8H11N3O2 — CID 123379844

IUPACN',5-dimethoxypyridine-2-carboximidamide
SMILESCON=C(N)c1ccc(OC)cn1
InChIInChI=1S/C8H11N3O2/c1-12-6-3-4-7(10-5-6)8(9)11-13-2/h3-5H,1-2H3,(H2,9,11)
InChIKeyKXXGCDXKSRPNGD-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.36
Rot. Bonds3

About N',5-dimethoxypyridine-2-carboximidamide

N',5-dimethoxypyridine-2-carboximidamide (PubChem CID 123379844) has the molecular formula C8H11N3O2 and a molecular weight of 181.19 g/mol. Its IUPAC name is N',5-dimethoxypyridine-2-carboximidamide.

Molecular Properties

Compound NameN',5-dimethoxypyridine-2-carboximidamide
PubChem CID123379844
Molecular FormulaC8H11N3O2
Molecular Weight181.19 g/mol
Exact Mass181.09
IUPAC NameN',5-dimethoxypyridine-2-carboximidamide
SMILESCON=C(N)c1ccc(OC)cn1
InChIInChI=1S/C8H11N3O2/c1-12-6-3-4-7(10-5-6)8(9)11-13-2/h3-5H,1-2H3,(H2,9,11)
InChIKeyKXXGCDXKSRPNGD-UHFFFAOYSA-N
XLogP0.36
TPSA69.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N',5-dimethoxypyridine-2-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-hydroxy-5-methoxypyridine-2-carboximidamide
CID 135743705
N'-methoxy-5-[4-[6-(N'-methoxycarbamimidoyl)-3-pyridinyl]phenyl]pyridine-2-carboximidamide
CID 91254126
5-methoxy-N'-piperidin-4-ylpyridine-2-carboximidamide
CID 144934608
5-(3,5-dimethoxyphenoxy)-N'-hydroxypyridine-2-carboximidamide
CID 136990840
5-methoxypyridine-2-carboximidamide;hydrochloride
CID 53484941
2-bromo-2-(5-methoxy-2-pyridinyl)ethenamine
CID 164558820
N'-hydroxy-5-[2-(2-methoxyethoxy)ethoxy]pyridine-2-carboximidamide
CID 136867042
N-(2-amino-2-oxoethyl)-5-methoxypyridine-2-carboxamide
CID 70798134
N'-hydroxy-5-(2-phenoxyethoxy)pyridine-2-carboximidamide
CID 136990781
N'-hydroxy-5-(2-piperidin-1-ylethoxy)pyridine-2-carboximidamide
CID 136990863
methyl 2-[(5-methoxypyridine-2-carbonyl)amino]acetate
CID 70798080
(4-bromophenyl)-(5-methoxy-2-pyridinyl)methanone
CID 170712986

Frequently Asked Questions

What is the IUPAC name of N',5-dimethoxypyridine-2-carboximidamide?
The IUPAC name of N',5-dimethoxypyridine-2-carboximidamide (CID 123379844) is N',5-dimethoxypyridine-2-carboximidamide.
What is the SMILES notation for N',5-dimethoxypyridine-2-carboximidamide?
The canonical SMILES for N',5-dimethoxypyridine-2-carboximidamide is CON=C(N)c1ccc(OC)cn1.
What is the InChIKey of N',5-dimethoxypyridine-2-carboximidamide?
The InChIKey is KXXGCDXKSRPNGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c1-12-6-3-4-7(10-5-6)8(9)11-13-2/h3-5H,1-2H3,(H2,9,11).
What are the key properties of N',5-dimethoxypyridine-2-carboximidamide?
N',5-dimethoxypyridine-2-carboximidamide has a molecular weight of 181.19 g/mol, XLogP of 0.36, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',5-dimethoxypyridine-2-carboximidamide is sourced from PubChem (CID 123379844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).