(E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine

C14H15N5O — CID 117063750

IUPAC(E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine
SMILESC(=N/N1CCOCC1)\c1ccnc(-c2ccccn2)n1
InChIInChI=1S/C14H15N5O/c1-2-5-15-13(3-1)14-16-6-4-12(18-14)11-17-19-7-9-20-10-8-19/h1-6,11H,7-10H2/b17-11+
InChIKeyNIRSZESTRJBNHV-GZTJUZNOSA-N
MW269.31 g/mol
LogP1.20
Rot. Bonds3

About (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine

(E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine (PubChem CID 117063750) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine.

Molecular Properties

Compound Name(E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine
PubChem CID117063750
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC Name(E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine
SMILESC(=N/N1CCOCC1)\c1ccnc(-c2ccccn2)n1
InChIInChI=1S/C14H15N5O/c1-2-5-15-13(3-1)14-16-6-4-12(18-14)11-17-19-7-9-20-10-8-19/h1-6,11H,7-10H2/b17-11+
InChIKeyNIRSZESTRJBNHV-GZTJUZNOSA-N
XLogP1.20
TPSA63.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

4-(4-pyridin-2-yl-1,3,5-triazin-2-yl)morpholine
CID 141107060
N-pyrrolidin-1-yl-1-[6-[6-(pyrrolidin-1-yliminomethyl)-2-pyridinyl]-2-pyridinyl]methanimine;dihydrochloride
CID 67929391
(E)-1-anthracen-9-yl-N-morpholin-4-ylmethanimine
CID 6898960
4-(5-bromo-2-pyridin-2-ylthieno[2,3-d]pyrimidin-4-yl)morpholine
CID 129255881
4-methyl-6-morpholin-4-yl-2-pyridin-2-ylpyrimidine-5-carboxylic acid
CID 139881756
4-[(2R)-1-cyclopentylpyrrolidin-2-yl]-2-pyridin-2-ylpyrimidine
CID 95816040
CID 139150015
CID 139150015
16-[[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]methyl]-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 14953575
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
(E)-N-morpholin-4-yl-1-(3-nitro-4-pyrimidin-2-ylsulfanylphenyl)methanimine
CID 6904910
4-[(Z)-morpholin-4-yliminomethyl]benzene-1,3-diol
CID 136904662
4-[(Z)-morpholin-4-yliminomethyl]benzene-1,2-diol
CID 135964584

Frequently Asked Questions

What is the IUPAC name of (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine?
The IUPAC name of (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine (CID 117063750) is (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine.
What is the SMILES notation for (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine?
The canonical SMILES for (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine is C(=N/N1CCOCC1)\c1ccnc(-c2ccccn2)n1.
What is the InChIKey of (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine?
The InChIKey is NIRSZESTRJBNHV-GZTJUZNOSA-N. The full InChI is InChI=1S/C14H15N5O/c1-2-5-15-13(3-1)14-16-6-4-12(18-14)11-17-19-7-9-20-10-8-19/h1-6,11H,7-10H2/b17-11+.
What are the key properties of (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine?
(E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine has a molecular weight of 269.31 g/mol, XLogP of 1.20, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-morpholin-4-yl-1-(2-pyridin-2-ylpyrimidin-4-yl)methanimine is sourced from PubChem (CID 117063750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).