4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine

C23H26N4O3 — CID 123624196

IUPAC4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine
SMILESCOc1ccc(C2CC2COc2nc(C)ncc2-c2ccnc(OC(C)C)c2)nc1
InChIInChI=1S/C23H26N4O3/c1-14(2)30-22-10-16(7-8-24-22)20-12-25-15(3)27-23(20)29-13-17-9-19(17)21-6-5-18(28-4)11-26-21/h5-8,10-12,14,17,19H,9,13H2,1-4H3
InChIKeySBPWRZYCUGIZMT-UHFFFAOYSA-N
MW406.49 g/mol
LogP4.22
Rot. Bonds8

About 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine

4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine (PubChem CID 123624196) has the molecular formula C23H26N4O3 and a molecular weight of 406.49 g/mol. Its IUPAC name is 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine.

Molecular Properties

Compound Name4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine
PubChem CID123624196
Molecular FormulaC23H26N4O3
Molecular Weight406.49 g/mol
Exact Mass406.20
IUPAC Name4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine
SMILESCOc1ccc(C2CC2COc2nc(C)ncc2-c2ccnc(OC(C)C)c2)nc1
InChIInChI=1S/C23H26N4O3/c1-14(2)30-22-10-16(7-8-24-22)20-12-25-15(3)27-23(20)29-13-17-9-19(17)21-6-5-18(28-4)11-26-21/h5-8,10-12,14,17,19H,9,13H2,1-4H3
InChIKeySBPWRZYCUGIZMT-UHFFFAOYSA-N
XLogP4.22
TPSA79.25 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.49
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine with MolForge

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Launch Full Analysis

Related Compounds

2-[[5-[4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]-2-pyridinyl]oxy]propane-1,3-diol
CID 123269816
5-[4-[[(1S,2S)-2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]-2-methylpyridazin-3-one
CID 118434178
5-[4-[[(1S,2S)-2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]-2-methyl-1,3-thiazole
CID 71488705
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-[6-(2H-tetrazol-5-yl)-3-pyridinyl]pyrimidine
CID 123528273
4-[[(1S,2S)-2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-[1-(3-methylbutyl)pyrazol-4-yl]pyrimidine
CID 71085899
3-[4-[4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]phenyl]-1,2,4-oxadiazole
CID 123839926
5-(3-methoxy-1-methylpyrazol-5-yl)-4-[[(2R)-2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidine
CID 144632580
5-methoxy-4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidine
CID 144632598
1-[5-[4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]-2-pyridinyl]cyclobutan-1-ol
CID 123926099
5-[4-[[(1S,2S)-2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]-4-methyl-1,3-oxazole
CID 90182321
1-(difluoromethyl)-5-[4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methylpyrimidin-5-yl]pyridin-2-one
CID 123583098

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine?
The IUPAC name of 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine (CID 123624196) is 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine.
What is the SMILES notation for 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine?
The canonical SMILES for 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine is COc1ccc(C2CC2COc2nc(C)ncc2-c2ccnc(OC(C)C)c2)nc1.
What is the InChIKey of 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine?
The InChIKey is SBPWRZYCUGIZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O3/c1-14(2)30-22-10-16(7-8-24-22)20-12-25-15(3)27-23(20)29-13-17-9-19(17)21-6-5-18(28-4)11-26-21/h5-8,10-12,14,17,19H,9,13H2,1-4H3.
What are the key properties of 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine?
4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine has a molecular weight of 406.49 g/mol, XLogP of 4.22, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(5-methoxy-2-pyridinyl)cyclopropyl]methoxy]-2-methyl-5-(2-propan-2-yloxy-4-pyridinyl)pyrimidine is sourced from PubChem (CID 123624196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).