7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane

C15H23N3O — CID 97451274

IUPAC7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane
SMILESCCc1cnc(N2CCC3(CC2)CC(OC)C3)nc1
InChIInChI=1S/C15H23N3O/c1-3-12-10-16-14(17-11-12)18-6-4-15(5-7-18)8-13(9-15)19-2/h10-11,13H,3-9H2,1-2H3
InChIKeyXJFSLTZDPFGWMV-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.43
Rot. Bonds3

About 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane

7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane (PubChem CID 97451274) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane
PubChem CID97451274
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane
SMILESCCc1cnc(N2CCC3(CC2)CC(OC)C3)nc1
InChIInChI=1S/C15H23N3O/c1-3-12-10-16-14(17-11-12)18-6-4-15(5-7-18)8-13(9-15)19-2/h10-11,13H,3-9H2,1-2H3
InChIKeyXJFSLTZDPFGWMV-UHFFFAOYSA-N
XLogP2.43
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-ethylpyrimidin-2-yl)-4-(hydroxymethyl)piperidin-4-ol
CID 56755831
5-ethyl-2-[4-[(1S)-1-methoxyethyl]piperidin-1-yl]pyrimidine
CID 131998372
8-(5-ethylpyrimidin-2-yl)-N,N-dimethyl-1-oxa-8-azaspiro[4.5]decan-3-amine
CID 131649217
(5R)-9-(5-ethylpyrimidin-2-yl)-2-(4-methoxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 58653471
2-methoxy-7-(6-methoxypyrimidin-4-yl)-7-azaspiro[3.5]nonane
CID 97451275
2-(5-ethylpyrimidin-2-yl)-9-(5-fluoropyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 134077441
7-(5-ethylpyrimidin-2-yl)-2-[2-[4-(tetrazol-1-yl)phenoxy]ethyl]-7-azaspiro[3.5]nonane
CID 56959849
5-ethyl-2-(4-propan-2-ylpiperidin-1-yl)pyrimidine;propane
CID 145380179
2-(5-ethylpyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 56756393
ethane;5-ethyl-2-(4-ethylpiperazin-1-yl)pyrimidine
CID 145380251
5-ethyl-2-(4-propylpiperazin-1-yl)pyrimidine
CID 168923337
2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]oxy-5-ethylpyrimidine
CID 138988924

Frequently Asked Questions

What is the IUPAC name of 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane?
The IUPAC name of 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane (CID 97451274) is 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane.
What is the SMILES notation for 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane?
The canonical SMILES for 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane is CCc1cnc(N2CCC3(CC2)CC(OC)C3)nc1.
What is the InChIKey of 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane?
The InChIKey is XJFSLTZDPFGWMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-3-12-10-16-14(17-11-12)18-6-4-15(5-7-18)8-13(9-15)19-2/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane?
7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane has a molecular weight of 261.37 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-ethylpyrimidin-2-yl)-2-methoxy-7-azaspiro[3.5]nonane is sourced from PubChem (CID 97451274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).