4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine

C15H25N3O — CID 138579238

IUPAC4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine
SMILESCC(C)c1cc(CN2CCOCC2)nc(C(C)C)n1
InChIInChI=1S/C15H25N3O/c1-11(2)14-9-13(16-15(17-14)12(3)4)10-18-5-7-19-8-6-18/h9,11-12H,5-8,10H2,1-4H3
InChIKeyAAIUBBHWTWVZFV-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.56
Rot. Bonds4

About 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine

4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine (PubChem CID 138579238) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine
PubChem CID138579238
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine
SMILESCC(C)c1cc(CN2CCOCC2)nc(C(C)C)n1
InChIInChI=1S/C15H25N3O/c1-11(2)14-9-13(16-15(17-14)12(3)4)10-18-5-7-19-8-6-18/h9,11-12H,5-8,10H2,1-4H3
InChIKeyAAIUBBHWTWVZFV-UHFFFAOYSA-N
XLogP2.56
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-chloro-6-propan-2-yl-1H-pyrrolo[3,2-c]pyridin-2-yl)methyl]morpholine
CID 144861420
4-[(2-propan-2-ylpyrimidin-4-yl)methyl]-1,4-oxazepane-6-carboxylic acid
CID 138377685
9-[2,6-di(propan-2-yl)pyrimidin-4-yl]-3-oxa-9-azaspiro[5.5]undecane
CID 131963146
4-chloro-6-(morpholin-4-ylmethyl)pyrimidin-2-amine
CID 105486071
2-N,2-N-dimethyl-4-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]-6-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 133431796
6-[[16-[[6-(dihydroxymethyl)-4-propan-2-yl-2-pyridinyl]methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]methyl]pyridine-2-carboxylic acid
CID 171639395
4-[(2-ethylsulfonyl-6-methylpyrimidin-4-yl)methyl]morpholine
CID 69292142
4-[(4-bromo-1-propan-2-ylimidazol-2-yl)methyl]morpholine
CID 117187554
2,6-bis(morpholin-4-ylmethyl)-4-propan-2-ylphenol
CID 3338042
4-morpholin-4-yl-6-propan-2-ylpyrimidine-2-carbaldehyde
CID 83896564
8-[(2-propan-2-ylpyrimidin-4-yl)methyl]-1-oxa-8-azaspiro[4.5]decane
CID 56866442
4-[(1-methyltriazol-4-yl)methyl]morpholine
CID 130163626

Frequently Asked Questions

What is the IUPAC name of 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine?
The IUPAC name of 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine (CID 138579238) is 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine.
What is the SMILES notation for 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine?
The canonical SMILES for 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine is CC(C)c1cc(CN2CCOCC2)nc(C(C)C)n1.
What is the InChIKey of 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine?
The InChIKey is AAIUBBHWTWVZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)14-9-13(16-15(17-14)12(3)4)10-18-5-7-19-8-6-18/h9,11-12H,5-8,10H2,1-4H3.
What are the key properties of 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine?
4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine has a molecular weight of 263.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2,6-di(propan-2-yl)pyrimidin-4-yl]methyl]morpholine is sourced from PubChem (CID 138579238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).