N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide

C16H16Cl2N4O2 — CID 121028270

IUPACN-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide
SMILESO=C(NCc1ccc(Cl)cc1Cl)c1ccc(N2CCOCC2)nn1
InChIInChI=1S/C16H16Cl2N4O2/c17-12-2-1-11(13(18)9-12)10-19-16(23)14-3-4-15(21-20-14)22-5-7-24-8-6-22/h1-4,9H,5-8,10H2,(H,19,23)
InChIKeyVNMVXOOYHVQHQC-UHFFFAOYSA-N
MW367.24 g/mol
LogP2.55
Rot. Bonds4

About N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide

N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide (PubChem CID 121028270) has the molecular formula C16H16Cl2N4O2 and a molecular weight of 367.24 g/mol. Its IUPAC name is N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide
PubChem CID121028270
Molecular FormulaC16H16Cl2N4O2
Molecular Weight367.24 g/mol
Exact Mass366.07
IUPAC NameN-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide
SMILESO=C(NCc1ccc(Cl)cc1Cl)c1ccc(N2CCOCC2)nn1
InChIInChI=1S/C16H16Cl2N4O2/c17-12-2-1-11(13(18)9-12)10-19-16(23)14-3-4-15(21-20-14)22-5-7-24-8-6-22/h1-4,9H,5-8,10H2,(H,19,23)
InChIKeyVNMVXOOYHVQHQC-UHFFFAOYSA-N
XLogP2.55
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.24
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-chlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide
CID 95986830
N-(4-chlorophenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114542
N-(furan-2-ylmethyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114455
N-(6-chloro-1,3-benzothiazol-2-yl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 121028174
N-(2,6-difluorophenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114612
6-morpholin-4-yl-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109114472
6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide
CID 109114518
6-morpholin-4-yl-N-propan-2-ylpyridazine-3-carboxamide
CID 109109608
N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 121028121
2-[3-(4-chloroanilino)-4-pyridinyl]-1-(6-morpholin-4-ylpyridazin-3-yl)ethanone
CID 147586968
N-[(4-chlorophenyl)methyl]-2-methyl-6-morpholin-4-ylpyrimidine-4-carboxamide
CID 109365353
methyl 6-morpholin-4-ylpyridazine-3-carboxylate
CID 121206139

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide?
The IUPAC name of N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide (CID 121028270) is N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide?
The canonical SMILES for N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide is O=C(NCc1ccc(Cl)cc1Cl)c1ccc(N2CCOCC2)nn1.
What is the InChIKey of N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide?
The InChIKey is VNMVXOOYHVQHQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N4O2/c17-12-2-1-11(13(18)9-12)10-19-16(23)14-3-4-15(21-20-14)22-5-7-24-8-6-22/h1-4,9H,5-8,10H2,(H,19,23).
What are the key properties of N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide?
N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide has a molecular weight of 367.24 g/mol, XLogP of 2.55, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dichlorophenyl)methyl]-6-morpholin-4-ylpyridazine-3-carboxamide is sourced from PubChem (CID 121028270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).