N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide

C16H18N4O2 — CID 71778586

IUPACN-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide
SMILESCN(C(=O)c1ccc(N2CCOCC2)nn1)c1ccccc1
InChIInChI=1S/C16H18N4O2/c1-19(13-5-3-2-4-6-13)16(21)14-7-8-15(18-17-14)20-9-11-22-12-10-20/h2-8H,9-12H2,1H3
InChIKeyDFHVPKPMGVIKDW-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.59
Rot. Bonds3

About N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide

N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide (PubChem CID 71778586) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide
PubChem CID71778586
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC NameN-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide
SMILESCN(C(=O)c1ccc(N2CCOCC2)nn1)c1ccccc1
InChIInChI=1S/C16H18N4O2/c1-19(13-5-3-2-4-6-13)16(21)14-7-8-15(18-17-14)20-9-11-22-12-10-20/h2-8H,9-12H2,1H3
InChIKeyDFHVPKPMGVIKDW-UHFFFAOYSA-N
XLogP1.59
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide (CID 71778586) is N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide is CN(C(=O)c1ccc(N2CCOCC2)nn1)c1ccccc1.
What is the InChIKey of N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide?
The InChIKey is DFHVPKPMGVIKDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c1-19(13-5-3-2-4-6-13)16(21)14-7-8-15(18-17-14)20-9-11-22-12-10-20/h2-8H,9-12H2,1H3.
What are the key properties of N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide?
N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide has a molecular weight of 298.35 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 71778586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).