4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one

C15H19ClN4O2 — CID 118870889

IUPAC4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one
SMILESCN1C=C(N)C=C(c2cc(N3CCOCC3)[nH]c(=O)c2)C1Cl
InChIInChI=1S/C15H19ClN4O2/c1-19-9-11(17)8-12(15(19)16)10-6-13(18-14(21)7-10)20-2-4-22-5-3-20/h6-9,15H,2-5,17H2,1H3,(H,18,21)
InChIKeyMABDHCBMEVTWSU-UHFFFAOYSA-N
MW322.80 g/mol
LogP0.91
Rot. Bonds2

About 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one

4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one (PubChem CID 118870889) has the molecular formula C15H19ClN4O2 and a molecular weight of 322.80 g/mol. Its IUPAC name is 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one
PubChem CID118870889
Molecular FormulaC15H19ClN4O2
Molecular Weight322.80 g/mol
Exact Mass322.12
IUPAC Name4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one
SMILESCN1C=C(N)C=C(c2cc(N3CCOCC3)[nH]c(=O)c2)C1Cl
InChIInChI=1S/C15H19ClN4O2/c1-19-9-11(17)8-12(15(19)16)10-6-13(18-14(21)7-10)20-2-4-22-5-3-20/h6-9,15H,2-5,17H2,1H3,(H,18,21)
InChIKeyMABDHCBMEVTWSU-UHFFFAOYSA-N
XLogP0.91
TPSA74.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.80
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

Analyze 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one with MolForge

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Related Compounds

6-(azepan-1-yl)-4-morpholin-4-yl-1H-pyridin-2-one
CID 156533558
4-(2-aminopyrimidin-5-yl)-2-morpholin-4-yl-1H-pyrimidin-6-one
CID 144988717
6-morpholin-4-yl-4-piperidin-1-yl-1H-pyrimidin-2-one
CID 155531007
2-methyl-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 135592113
2-chloro-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 137130492
8-chloro-2-morpholin-4-yl-1H-1,7-naphthyridin-4-one;ethane
CID 145012194
3-(3-amino-4-morpholin-4-ylphenyl)-1H-pyridazin-6-one
CID 25249937
4-(1H-indazol-5-yl)-6-pyrrolidin-1-yl-1H-pyridin-2-one
CID 59028174
4-(5-amino-2-chloro-3-pyridinyl)-1-methyl-6-morpholin-4-ylpyridin-2-one
CID 90456645
8-(2-acetylphenyl)-2-morpholin-4-yl-1H-quinolin-4-one
CID 69199746
4-morpholin-4-yl-3-phenyl-1H-pyridazin-6-one
CID 3770299
6-methoxy-3-morpholin-4-yl-2H-isoquinolin-1-one
CID 22250132

Frequently Asked Questions

What is the IUPAC name of 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one?
The IUPAC name of 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one (CID 118870889) is 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one.
What is the SMILES notation for 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one?
The canonical SMILES for 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one is CN1C=C(N)C=C(c2cc(N3CCOCC3)[nH]c(=O)c2)C1Cl.
What is the InChIKey of 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one?
The InChIKey is MABDHCBMEVTWSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN4O2/c1-19-9-11(17)8-12(15(19)16)10-6-13(18-14(21)7-10)20-2-4-22-5-3-20/h6-9,15H,2-5,17H2,1H3,(H,18,21).
What are the key properties of 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one?
4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one has a molecular weight of 322.80 g/mol, XLogP of 0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-amino-2-chloro-1-methyl-2H-pyridin-3-yl)-6-morpholin-4-yl-1H-pyridin-2-one is sourced from PubChem (CID 118870889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).