[(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol

C14H22N4O2 — CID 100653088

IUPAC[(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol
SMILESC[C@H]1CN(c2cc(N3CCCC3)ncn2)C[C@@H](CO)O1
InChIInChI=1S/C14H22N4O2/c1-11-7-18(8-12(9-19)20-11)14-6-13(15-10-16-14)17-4-2-3-5-17/h6,10-12,19H,2-5,7-9H2,1H3/t11-,12-/m0/s1
InChIKeyBBPXDNJHJGIKQV-RYUDHWBXSA-N
MW278.36 g/mol
LogP0.66
Rot. Bonds3

About [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol

[(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol (PubChem CID 100653088) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol.

Molecular Properties

Compound Name[(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol
PubChem CID100653088
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name[(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol
SMILESC[C@H]1CN(c2cc(N3CCCC3)ncn2)C[C@@H](CO)O1
InChIInChI=1S/C14H22N4O2/c1-11-7-18(8-12(9-19)20-11)14-6-13(15-10-16-14)17-4-2-3-5-17/h6,10-12,19H,2-5,7-9H2,1H3/t11-,12-/m0/s1
InChIKeyBBPXDNJHJGIKQV-RYUDHWBXSA-N
XLogP0.66
TPSA61.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol with MolForge

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Related Compounds

[4-[5-(hydroxymethyl)pyrazin-2-yl]-6-methylmorpholin-2-yl]methanol
CID 107372998
[4-(6-chloro-2-methylpyrimidin-4-yl)-6-methylmorpholin-2-yl]methanol
CID 102933937
(2R,6R)-2,6-dimethyl-4-(6-methylpyrimidin-4-yl)morpholine
CID 42270575
1-(6-piperidin-1-ylpyrimidin-4-yl)azepane
CID 112856077
[4-(6-fluoro-2-pyridinyl)-6-methylmorpholin-2-yl]methanol
CID 102933936
(6-methyl-4-quinolin-2-ylmorpholin-2-yl)methanol
CID 102935336
[4-(6-chloro-5-ethylpyrimidin-4-yl)-6-methylmorpholin-2-yl]methanol
CID 102933974
2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-6-methylpyridine-4-carbonitrile
CID 102932797
2-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]pyrimidine-5-carbaldehyde
CID 102933302
[4-(3-aminopyrazin-2-yl)-6-methylmorpholin-2-yl]methanol
CID 102976001
[6-methyl-4-(6-propoxypyrimidin-4-yl)morpholin-2-yl]methanamine
CID 102938720
[4-[5-(hydroxymethyl)-2-methyl-4-pyridinyl]-6-methylmorpholin-2-yl]methanol
CID 102935345

Frequently Asked Questions

What is the IUPAC name of [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol?
The IUPAC name of [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol (CID 100653088) is [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol.
What is the SMILES notation for [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol?
The canonical SMILES for [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol is C[C@H]1CN(c2cc(N3CCCC3)ncn2)C[C@@H](CO)O1.
What is the InChIKey of [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol?
The InChIKey is BBPXDNJHJGIKQV-RYUDHWBXSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-11-7-18(8-12(9-19)20-11)14-6-13(15-10-16-14)17-4-2-3-5-17/h6,10-12,19H,2-5,7-9H2,1H3/t11-,12-/m0/s1.
What are the key properties of [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol?
[(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol has a molecular weight of 278.36 g/mol, XLogP of 0.66, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,6S)-6-methyl-4-(6-pyrrolidin-1-ylpyrimidin-4-yl)morpholin-2-yl]methanol is sourced from PubChem (CID 100653088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).