N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide

C16H17N5O3 — CID 121028121

IUPACN-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
SMILESNC(=O)c1ccc(NC(=O)c2ccc(N3CCOCC3)nn2)cc1
InChIInChI=1S/C16H17N5O3/c17-15(22)11-1-3-12(4-2-11)18-16(23)13-5-6-14(20-19-13)21-7-9-24-10-8-21/h1-6H,7-10H2,(H2,17,22)(H,18,23)
InChIKeyQLCOWFFZQNONSY-UHFFFAOYSA-N
MW327.34 g/mol
LogP0.66
Rot. Bonds4

About N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide

N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide (PubChem CID 121028121) has the molecular formula C16H17N5O3 and a molecular weight of 327.34 g/mol. Its IUPAC name is N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
PubChem CID121028121
Molecular FormulaC16H17N5O3
Molecular Weight327.34 g/mol
Exact Mass327.13
IUPAC NameN-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
SMILESNC(=O)c1ccc(NC(=O)c2ccc(N3CCOCC3)nn2)cc1
InChIInChI=1S/C16H17N5O3/c17-15(22)11-1-3-12(4-2-11)18-16(23)13-5-6-14(20-19-13)21-7-9-24-10-8-21/h1-6H,7-10H2,(H2,17,22)(H,18,23)
InChIKeyQLCOWFFZQNONSY-UHFFFAOYSA-N
XLogP0.66
TPSA110.44 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.34
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-morpholin-4-yl-N-phenylpyridazine-3-carboxamide
CID 109114518
N-(4-chlorophenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114542
N-[4-(diethylamino)phenyl]-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114572
N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114560
N-(2,6-difluorophenyl)-6-morpholin-4-ylpyridazine-3-carboxamide
CID 109114612
N-(4-morpholin-4-ylphenyl)-6-(1,2,4-triazol-1-yl)pyridazine-3-carboxamide
CID 71805129
6-morpholin-4-yl-N-propan-2-ylpyridazine-3-carboxamide
CID 109109608
methyl 4-[[6-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)pyridazine-3-carbonyl]amino]benzoate
CID 109123556
6-[4-(4-hydroxyphenyl)piperazin-1-yl]-N-phenylpyridazine-3-carboxamide
CID 133313205
N-[4-[(6-morpholin-4-ylpyridazin-3-yl)amino]phenyl]benzamide
CID 6457766
methyl 6-morpholin-4-ylpyridazine-3-carboxylate
CID 121206139
6-(1,4-oxazepan-4-yl)pyridazine-3-carboxylic acid
CID 62973875

Frequently Asked Questions

What is the IUPAC name of N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The IUPAC name of N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide (CID 121028121) is N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The canonical SMILES for N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide is NC(=O)c1ccc(NC(=O)c2ccc(N3CCOCC3)nn2)cc1.
What is the InChIKey of N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide?
The InChIKey is QLCOWFFZQNONSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O3/c17-15(22)11-1-3-12(4-2-11)18-16(23)13-5-6-14(20-19-13)21-7-9-24-10-8-21/h1-6H,7-10H2,(H2,17,22)(H,18,23).
What are the key properties of N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide?
N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide has a molecular weight of 327.34 g/mol, XLogP of 0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-carbamoylphenyl)-6-morpholin-4-ylpyridazine-3-carboxamide is sourced from PubChem (CID 121028121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).