[4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol

C14H22N4O — CID 166266789

IUPAC[4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol
SMILESCc1cc(N2CCC3(CCCNC3)C2)nc(CO)n1
InChIInChI=1S/C14H22N4O/c1-11-7-13(17-12(8-19)16-11)18-6-4-14(10-18)3-2-5-15-9-14/h7,15,19H,2-6,8-10H2,1H3
InChIKeyOMPWSTYQEXAXJF-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.86
Rot. Bonds2

About [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol

[4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol (PubChem CID 166266789) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol.

Molecular Properties

Compound Name[4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol
PubChem CID166266789
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name[4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol
SMILESCc1cc(N2CCC3(CCCNC3)C2)nc(CO)n1
InChIInChI=1S/C14H22N4O/c1-11-7-13(17-12(8-19)16-11)18-6-4-14(10-18)3-2-5-15-9-14/h7,15,19H,2-6,8-10H2,1H3
InChIKeyOMPWSTYQEXAXJF-UHFFFAOYSA-N
XLogP0.86
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[4-(azetidin-1-yl)-6-methylpyrimidin-2-yl]methanol
CID 130978683
(5S)-2-(4-methylpyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 95222078
9-(2-ethyl-6-methylpyrimidin-4-yl)-3,9-diazaspiro[5.6]dodecane;dihydrochloride
CID 154907815
(5S)-2-pyrazin-2-yl-2,9-diazaspiro[4.5]decane
CID 95203740
2-pyrazin-2-yl-2,9-diazaspiro[4.5]decane
CID 56750395
2-(2-methylpyrimidin-4-yl)-2,8-diazaspiro[5.5]undecane
CID 102850690
2-(5-ethylpyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 56756393
2-(2-methyl-4-pyridinyl)-2,8-diazaspiro[3.5]nonane
CID 152657407
(5S)-2-(4-methylpyrimidin-2-yl)-2,7-diazaspiro[4.4]nonane
CID 170131044
2-pyrimidin-4-yl-2,8-diazaspiro[5.5]undecane
CID 102850610
[1-(2-butyl-6-methylpyrimidin-4-yl)-3-propylpyrrolidin-3-yl]methanol
CID 126798161
2-(2,8-diazaspiro[5.5]undecan-2-yl)-4,5-dimethyl-1,3-thiazole
CID 102850533

Frequently Asked Questions

What is the IUPAC name of [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol?
The IUPAC name of [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol (CID 166266789) is [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol.
What is the SMILES notation for [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol?
The canonical SMILES for [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol is Cc1cc(N2CCC3(CCCNC3)C2)nc(CO)n1.
What is the InChIKey of [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol?
The InChIKey is OMPWSTYQEXAXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-11-7-13(17-12(8-19)16-11)18-6-4-14(10-18)3-2-5-15-9-14/h7,15,19H,2-6,8-10H2,1H3.
What are the key properties of [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol?
[4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol has a molecular weight of 262.36 g/mol, XLogP of 0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol is sourced from PubChem (CID 166266789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).