N'-(4-ethoxyphenyl)pyridine-4-carboximidamide

C14H15N3O — CID 12826054

IUPACN'-(4-ethoxyphenyl)pyridine-4-carboximidamide
SMILESCCOc1ccc(/N=C(\N)c2ccncc2)cc1
InChIInChI=1S/C14H15N3O/c1-2-18-13-5-3-12(4-6-13)17-14(15)11-7-9-16-10-8-11/h3-10H,2H2,1H3,(H2,15,17)
InChIKeyJQOTWMONEGJRRZ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.52
Rot. Bonds4

About N'-(4-ethoxyphenyl)pyridine-4-carboximidamide

N'-(4-ethoxyphenyl)pyridine-4-carboximidamide (PubChem CID 12826054) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is N'-(4-ethoxyphenyl)pyridine-4-carboximidamide.

Molecular Properties

Compound NameN'-(4-ethoxyphenyl)pyridine-4-carboximidamide
PubChem CID12826054
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC NameN'-(4-ethoxyphenyl)pyridine-4-carboximidamide
SMILESCCOc1ccc(/N=C(\N)c2ccncc2)cc1
InChIInChI=1S/C14H15N3O/c1-2-18-13-5-3-12(4-6-13)17-14(15)11-7-9-16-10-8-11/h3-10H,2H2,1H3,(H2,15,17)
InChIKeyJQOTWMONEGJRRZ-UHFFFAOYSA-N
XLogP2.52
TPSA60.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[amino(pyridin-4-yl)methylidene]-2,4-diethoxybenzamide
CID 143910129
1-(diaminomethylidene)-2-(4-ethoxyphenyl)guanidine
CID 29671
4-(4-ethoxyphenyl)imino-3-methylpent-2-en-2-amine
CID 3849163
(Z)-4-(4-ethoxyphenyl)imino-3-methylpent-2-en-2-amine
CID 6809323
N'-(4-ethoxybenzoyl)pyridine-4-carbohydrazide
CID 959949
4-(4-ethoxyphenoxy)-N'-hydroxybenzenecarboximidamide
CID 43188257
2-(4-ethoxyphenyl)-1,1,3,3-tetramethylguanidine
CID 525247
N-[2-[(4-ethoxybenzoyl)amino]ethyl]pyridine-4-carboxamide
CID 108540562
4-[(4-ethoxyphenoxy)methyl]-N'-hydroxybenzenecarboximidamide
CID 24690580
1-(4-ethoxyphenyl)ethenamine
CID 129289710
N'-[(Z)-[amino(pyridin-4-yl)methylidene]amino]pyridine-4-carboximidamide
CID 172958470
2-(4-ethoxyphenyl)-1,3-bis(4-methoxyphenyl)guanidine;hydrochloride
CID 10827

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethoxyphenyl)pyridine-4-carboximidamide?
The IUPAC name of N'-(4-ethoxyphenyl)pyridine-4-carboximidamide (CID 12826054) is N'-(4-ethoxyphenyl)pyridine-4-carboximidamide.
What is the SMILES notation for N'-(4-ethoxyphenyl)pyridine-4-carboximidamide?
The canonical SMILES for N'-(4-ethoxyphenyl)pyridine-4-carboximidamide is CCOc1ccc(/N=C(\N)c2ccncc2)cc1.
What is the InChIKey of N'-(4-ethoxyphenyl)pyridine-4-carboximidamide?
The InChIKey is JQOTWMONEGJRRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-2-18-13-5-3-12(4-6-13)17-14(15)11-7-9-16-10-8-11/h3-10H,2H2,1H3,(H2,15,17).
What are the key properties of N'-(4-ethoxyphenyl)pyridine-4-carboximidamide?
N'-(4-ethoxyphenyl)pyridine-4-carboximidamide has a molecular weight of 241.29 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethoxyphenyl)pyridine-4-carboximidamide is sourced from PubChem (CID 12826054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).