1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea

C11H17N5O3 — CID 108887315

IUPAC1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea
SMILESO=C(NCCN1CCOCC1)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C11H17N5O3/c17-10-2-1-9(14-15-10)13-11(18)12-3-4-16-5-7-19-8-6-16/h1-2H,3-8H2,(H,15,17)(H2,12,13,14,18)
InChIKeyQVJWEXSCEPWCIX-UHFFFAOYSA-N
MW267.29 g/mol
LogP-0.78
Rot. Bonds4

About 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea

1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea (PubChem CID 108887315) has the molecular formula C11H17N5O3 and a molecular weight of 267.29 g/mol. Its IUPAC name is 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea.

Molecular Properties

Compound Name1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea
PubChem CID108887315
Molecular FormulaC11H17N5O3
Molecular Weight267.29 g/mol
Exact Mass267.13
IUPAC Name1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea
SMILESO=C(NCCN1CCOCC1)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C11H17N5O3/c17-10-2-1-9(14-15-10)13-11(18)12-3-4-16-5-7-19-8-6-16/h1-2H,3-8H2,(H,15,17)(H2,12,13,14,18)
InChIKeyQVJWEXSCEPWCIX-UHFFFAOYSA-N
XLogP-0.78
TPSA99.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 5-0.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-Cyano-2-methyl-3-[4-(3-morpholin-4-yl-6-oxopyridazin-1-yl)butyl]guanidine
CID 12850798
2-(2-Morpholin-4-ylethyl)-6-piperazin-1-ylpyridazin-3-one
CID 59144387
2-(2-Morpholin-4-yl-2-oxoethyl)-6-piperazin-1-ylpyridazin-3-one
CID 68026825
2-(4-Aminobutyl)-6-(4-morpholinyl)-3(2H)-pyridazinone
CID 13103558
N-(3-methoxypropyl)-2-(3-morpholino-6-oxopyridazin-1(6H)-yl)acetamide
CID 52900298
N-(2-methylpropyl)-2-[3-(morpholin-4-yl)-6-oxopyridazin-1(6H)-yl]acetamide
CID 52900977
N-isopropyl-2-(3-morpholino-6-oxopyridazin-1(6H)-yl)acetamide
CID 56762141
N-(2-methoxyethyl)-2-(3-morpholino-6-oxopyridazin-1(6H)-yl)acetamide
CID 60178929
6-(2-morpholin-4-ylethylamino)-2H-[1,2,4]triazolo[4,3-b]pyridazin-3-one
CID 66284384
2-[2-(Methylamino)ethyl]-6-morpholin-4-ylpyridazin-3-one
CID 101628232
N-(6-oxo-1H-pyridazin-3-yl)piperazine-1-carboxamide
CID 108887200
2,6-dimethyl-N-(6-oxo-1H-pyridazin-3-yl)morpholine-4-carboxamide
CID 108887229

Frequently Asked Questions

What is the IUPAC name of 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea?
The IUPAC name of 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea (CID 108887315) is 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea.
What is the SMILES notation for 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea?
The canonical SMILES for 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea is O=C(NCCN1CCOCC1)Nc1ccc(=O)[nH]n1.
What is the InChIKey of 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea?
The InChIKey is QVJWEXSCEPWCIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O3/c17-10-2-1-9(14-15-10)13-11(18)12-3-4-16-5-7-19-8-6-16/h1-2H,3-8H2,(H,15,17)(H2,12,13,14,18).
What are the key properties of 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea?
1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea has a molecular weight of 267.29 g/mol, XLogP of -0.78, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-morpholin-4-ylethyl)-3-(6-oxo-1H-pyridazin-3-yl)urea is sourced from PubChem (CID 108887315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).