2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine

C20H21N5O — CID 144632677

IUPAC2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine
SMILESCc1ccc([C@@H]2C[C@H]2COc2nc(C)ncc2-c2cnnc(C)c2)nc1
InChIInChI=1S/C20H21N5O/c1-12-4-5-19(22-8-12)17-7-16(17)11-26-20-18(10-21-14(3)24-20)15-6-13(2)25-23-9-15/h4-6,8-10,16-17H,7,11H2,1-3H3/t16-,17+/m0/s1
InChIKeyIPYLKNMVVUUCHK-DLBZAZTESA-N
MW347.42 g/mol
LogP3.44
Rot. Bonds5

About 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine

2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine (PubChem CID 144632677) has the molecular formula C20H21N5O and a molecular weight of 347.42 g/mol. Its IUPAC name is 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine.

Molecular Properties

Compound Name2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine
PubChem CID144632677
Molecular FormulaC20H21N5O
Molecular Weight347.42 g/mol
Exact Mass347.17
IUPAC Name2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine
SMILESCc1ccc([C@@H]2C[C@H]2COc2nc(C)ncc2-c2cnnc(C)c2)nc1
InChIInChI=1S/C20H21N5O/c1-12-4-5-19(22-8-12)17-7-16(17)11-26-20-18(10-21-14(3)24-20)15-6-13(2)25-23-9-15/h4-6,8-10,16-17H,7,11H2,1-3H3/t16-,17+/m0/s1
InChIKeyIPYLKNMVVUUCHK-DLBZAZTESA-N
XLogP3.44
TPSA73.68 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine with MolForge

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Related Compounds

1,3-dimethyl-5-[2-methyl-4-[[2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidin-5-yl]pyridin-2-one
CID 129160088
3-methyl-6-[2-methyl-4-[[(2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidin-5-yl]imidazo[1,2-a]pyridine
CID 129167406
1-ethyl-5-[2-methyl-4-[[2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidin-5-yl]pyridin-2-one
CID 129159916
methane;methyl 2-[4-[2-methyl-4-[[2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidin-5-yl]-2-oxo-1-pyridinyl]acetate
CID 144632481
5-[4-[[(1S,2S)-2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]-2-methylpyridazin-3-one
CID 118434178
5-(4,4-dimethylcyclohexyl)-2-methyl-4-[[(1S,2S)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine
CID 129167315
4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-[6-(2H-tetrazol-5-yl)-3-pyridinyl]pyrimidine
CID 123528273
4-[4-[[(1S)-2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]benzoic acid
CID 118474071
4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine
CID 123624196
3-[4-[4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]phenyl]-1,2,4-oxadiazole
CID 123839926
2-[(1R)-2-(ethoxymethyl)cyclopropyl]-5-methylpyridine
CID 129167431
5-[4-[[(1S,2S)-2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]-2-methyl-1,3-thiazole
CID 71488705

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine?
The IUPAC name of 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine (CID 144632677) is 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine.
What is the SMILES notation for 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine?
The canonical SMILES for 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine is Cc1ccc([C@@H]2C[C@H]2COc2nc(C)ncc2-c2cnnc(C)c2)nc1.
What is the InChIKey of 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine?
The InChIKey is IPYLKNMVVUUCHK-DLBZAZTESA-N. The full InChI is InChI=1S/C20H21N5O/c1-12-4-5-19(22-8-12)17-7-16(17)11-26-20-18(10-21-14(3)24-20)15-6-13(2)25-23-9-15/h4-6,8-10,16-17H,7,11H2,1-3H3/t16-,17+/m0/s1.
What are the key properties of 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine?
2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine has a molecular weight of 347.42 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(6-methylpyridazin-4-yl)-4-[[(1R,2R)-2-(5-methyl-2-pyridinyl)cyclopropyl]methoxy]pyrimidine is sourced from PubChem (CID 144632677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).