[9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone

C19H23N5O2 — CID 131662967

IUPAC[9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone
SMILESCOc1cc(N2CCCC3(CCN(C(=O)c4ccccn4)C3)C2)ncn1
InChIInChI=1S/C19H23N5O2/c1-26-17-11-16(21-14-22-17)23-9-4-6-19(12-23)7-10-24(13-19)18(25)15-5-2-3-8-20-15/h2-3,5,8,11,14H,4,6-7,9-10,12-13H2,1H3
InChIKeyNALUTPGQVIPWTN-UHFFFAOYSA-N
MW353.43 g/mol
LogP2.01
Rot. Bonds3

About [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone

[9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone (PubChem CID 131662967) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone.

Molecular Properties

Compound Name[9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone
PubChem CID131662967
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name[9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone
SMILESCOc1cc(N2CCCC3(CCN(C(=O)c4ccccn4)C3)C2)ncn1
InChIInChI=1S/C19H23N5O2/c1-26-17-11-16(21-14-22-17)23-9-4-6-19(12-23)7-10-24(13-19)18(25)15-5-2-3-8-20-15/h2-3,5,8,11,14H,4,6-7,9-10,12-13H2,1H3
InChIKeyNALUTPGQVIPWTN-UHFFFAOYSA-N
XLogP2.01
TPSA71.45 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone with MolForge

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Related Compounds

1-[(5R)-2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]ethanone
CID 97415473
1H-indol-5-yl-[9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]methanone
CID 131656588
(5S)-N-cyclohexyl-9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decane-2-carboxamide
CID 97483665
[(5S)-9-[(3-methoxyphenyl)methyl]-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone
CID 97482697
2-azaspiro[5.5]undecan-2-yl(pyridin-2-yl)methanone
CID 127305942
pyrazin-2-yl-[(5R)-2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone
CID 97450157
(4-methoxyphenyl)-(2-pyridin-2-yl-2,9-diazaspiro[5.5]undecan-9-yl)methanone
CID 3235378
(5R)-N,N-dimethyl-9-pyridin-2-yl-2,9-diazaspiro[4.5]decane-2-carboxamide
CID 97483862
[(5S)-9-pyridin-2-yl-2,9-diazaspiro[4.5]decan-2-yl]-pyrrolidin-1-ylmethanone
CID 97483871
(6-methoxypyrimidin-4-yl)-(9-oxa-2-azaspiro[5.5]undecan-2-yl)methanone
CID 136564099
1-(2-pyridin-2-yl-2,7-diazaspiro[4.5]decan-7-yl)ethanone
CID 134074831
7-(5-fluoropyrimidin-2-yl)-2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decane
CID 134080133

Frequently Asked Questions

What is the IUPAC name of [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone?
The IUPAC name of [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone (CID 131662967) is [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone.
What is the SMILES notation for [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone?
The canonical SMILES for [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone is COc1cc(N2CCCC3(CCN(C(=O)c4ccccn4)C3)C2)ncn1.
What is the InChIKey of [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone?
The InChIKey is NALUTPGQVIPWTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-26-17-11-16(21-14-22-17)23-9-4-6-19(12-23)7-10-24(13-19)18(25)15-5-2-3-8-20-15/h2-3,5,8,11,14H,4,6-7,9-10,12-13H2,1H3.
What are the key properties of [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone?
[9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone has a molecular weight of 353.43 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [9-(6-methoxypyrimidin-4-yl)-2,9-diazaspiro[4.5]decan-2-yl]-pyridin-2-ylmethanone is sourced from PubChem (CID 131662967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).