N-ethenoxy-1-pyridin-4-ylmethanamine

C8H10N2O — CID 23559811

IUPACN-ethenoxy-1-pyridin-4-ylmethanamine
SMILESC=CONCc1ccncc1
InChIInChI=1S/C8H10N2O/c1-2-11-10-7-8-3-5-9-6-4-8/h2-6,10H,1,7H2
InChIKeyDIFBYQGTGJDWAS-UHFFFAOYSA-N
MW150.18 g/mol
LogP1.25
Rot. Bonds4

About N-ethenoxy-1-pyridin-4-ylmethanamine

N-ethenoxy-1-pyridin-4-ylmethanamine (PubChem CID 23559811) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is N-ethenoxy-1-pyridin-4-ylmethanamine.

Molecular Properties

Compound NameN-ethenoxy-1-pyridin-4-ylmethanamine
PubChem CID23559811
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC NameN-ethenoxy-1-pyridin-4-ylmethanamine
SMILESC=CONCc1ccncc1
InChIInChI=1S/C8H10N2O/c1-2-11-10-7-8-3-5-9-6-4-8/h2-6,10H,1,7H2
InChIKeyDIFBYQGTGJDWAS-UHFFFAOYSA-N
XLogP1.25
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

O-(pyridin-4-ylmethylamino)hydroxylamine
CID 142271558
N-phosphanyl-1-pyridin-4-ylmethanamine
CID 144767456
N-[(3-prop-2-enoxyphenyl)methyl]-1-pyridin-4-ylmethanamine;dihydrochloride
CID 163327937
N,N'-bis(pyridin-4-ylmethyl)pentane-1,5-diamine
CID 101163000
1,1-dimethyl-2-(pyridin-4-ylmethyl)hydrazine
CID 21117152
1-(3-prop-2-enoxyphenyl)-3-(pyridin-4-ylmethyl)thiourea
CID 100596497
N-prop-2-enyl-2-(pyridin-4-ylmethylamino)acetamide
CID 108992941
N-ethenyl-2-pyridin-4-ylacetamide
CID 174939088
1-cyclopropyl-N-(pyridin-4-ylmethyl)methanamine;hydrochloride
CID 167733766
1-methyl-3-(pyridin-4-ylmethyl)thiourea
CID 2725230
2-oxo-N-(pyridin-4-ylmethyl)acetamide
CID 88952293
molecular hydrogen;N-(pyridin-4-ylmethyl)ethanamine
CID 145190725

Frequently Asked Questions

What is the IUPAC name of N-ethenoxy-1-pyridin-4-ylmethanamine?
The IUPAC name of N-ethenoxy-1-pyridin-4-ylmethanamine (CID 23559811) is N-ethenoxy-1-pyridin-4-ylmethanamine.
What is the SMILES notation for N-ethenoxy-1-pyridin-4-ylmethanamine?
The canonical SMILES for N-ethenoxy-1-pyridin-4-ylmethanamine is C=CONCc1ccncc1.
What is the InChIKey of N-ethenoxy-1-pyridin-4-ylmethanamine?
The InChIKey is DIFBYQGTGJDWAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-2-11-10-7-8-3-5-9-6-4-8/h2-6,10H,1,7H2.
What are the key properties of N-ethenoxy-1-pyridin-4-ylmethanamine?
N-ethenoxy-1-pyridin-4-ylmethanamine has a molecular weight of 150.18 g/mol, XLogP of 1.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenoxy-1-pyridin-4-ylmethanamine is sourced from PubChem (CID 23559811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).