4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine

C12H14N4O — CID 175916253

IUPAC4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine
SMILESCc1nncc2cnc(N3CCOCC3)cc12
InChIInChI=1S/C12H14N4O/c1-9-11-6-12(16-2-4-17-5-3-16)13-7-10(11)8-14-15-9/h6-8H,2-5H2,1H3
InChIKeyXBFJJPMHAWMVKE-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.17
Rot. Bonds1

About 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine

4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine (PubChem CID 175916253) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine.

Molecular Properties

Compound Name4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine
PubChem CID175916253
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine
SMILESCc1nncc2cnc(N3CCOCC3)cc12
InChIInChI=1S/C12H14N4O/c1-9-11-6-12(16-2-4-17-5-3-16)13-7-10(11)8-14-15-9/h6-8H,2-5H2,1H3
InChIKeyXBFJJPMHAWMVKE-UHFFFAOYSA-N
XLogP1.17
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(1-methylphthalazin-6-yl)morpholine
CID 175916256
1-(7-methyl-3-morpholin-4-ylisoquinolin-5-yl)ethanone
CID 171520543
4-(6,7-diethoxyisoquinolin-3-yl)morpholine
CID 944829
4-(4-chloro-5-methyl-2-pyridinyl)morpholine
CID 142202781
4-[6-(azepan-1-yl)-2-methylpyrimidin-4-yl]morpholine
CID 112869889
(1S)-1-(4-methyl-6-morpholin-4-yl-3-pyridinyl)ethanol
CID 124501974
5-(2,6-dimorpholin-4-yl-4-pyridinyl)-6-methylpyridin-3-amine
CID 168929038
4-(2,3,6-trimethyl-4-pyridinyl)morpholine
CID 172568291
4-(4,6-dimethylimidazo[1,5-a]pyrimidin-2-yl)morpholine
CID 13114273
4-(2-morpholin-4-yl-6-pyrrolidin-1-ylpyrimidin-4-yl)morpholine
CID 67897493
4-[6-[4-(2,6-dimethylpyrimidin-4-yl)piperazin-1-yl]-2-methylpyrimidin-4-yl]morpholine
CID 146078312
N-[(1R)-1-(2-fluoro-3-methylphenyl)ethyl]-4-methyl-7-morpholin-4-ylpyrido[3,4-d]pyridazin-1-amine
CID 158039526

Frequently Asked Questions

What is the IUPAC name of 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine?
The IUPAC name of 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine (CID 175916253) is 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine.
What is the SMILES notation for 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine?
The canonical SMILES for 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine is Cc1nncc2cnc(N3CCOCC3)cc12.
What is the InChIKey of 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine?
The InChIKey is XBFJJPMHAWMVKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c1-9-11-6-12(16-2-4-17-5-3-16)13-7-10(11)8-14-15-9/h6-8H,2-5H2,1H3.
What are the key properties of 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine?
4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine has a molecular weight of 230.27 g/mol, XLogP of 1.17, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylpyrido[3,4-d]pyridazin-7-yl)morpholine is sourced from PubChem (CID 175916253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).