[2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone

C19H23N5O2 — CID 118742924

IUPAC[2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone
SMILESCOc1cc(N2CCC3(CCCN(C(=O)c4cccnc4)C3)C2)ncn1
InChIInChI=1S/C19H23N5O2/c1-26-17-10-16(21-14-22-17)23-9-6-19(12-23)5-3-8-24(13-19)18(25)15-4-2-7-20-11-15/h2,4,7,10-11,14H,3,5-6,8-9,12-13H2,1H3
InChIKeyZPCMAVZIMSQKTJ-UHFFFAOYSA-N
MW353.43 g/mol
LogP2.01
Rot. Bonds3

About [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone

[2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone (PubChem CID 118742924) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone.

Molecular Properties

Compound Name[2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone
PubChem CID118742924
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name[2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone
SMILESCOc1cc(N2CCC3(CCCN(C(=O)c4cccnc4)C3)C2)ncn1
InChIInChI=1S/C19H23N5O2/c1-26-17-10-16(21-14-22-17)23-9-6-19(12-23)5-3-8-24(13-19)18(25)15-4-2-7-20-11-15/h2,4,7,10-11,14H,3,5-6,8-9,12-13H2,1H3
InChIKeyZPCMAVZIMSQKTJ-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 [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone with MolForge

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Related Compounds

[3-[6-[(4-Methoxy-2-pyridinyl)amino]-2-methylpyrimidin-4-yl]piperidin-1-yl]-phenylmethanone
CID 118725469
N-[1-(6-methoxypyrimidin-4-yl)piperidin-4-yl]-N-methyl-7-oxo-6-prop-2-enyl-1H-pyrrolo[2,3-c]pyridine-4-carboxamide
CID 121338401
5-[[4-[(4-Methoxy-2-pyridinyl)amino]-1-piperidinyl]carbonyl]-2-pyridinecarbonitrile
CID 56659435
(3-Fluorophenyl)-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]methanone
CID 22617927
US11377438, Example 143
CID 146525801
US11377438, Example 2
CID 146526012
pyridin-4-yl-[(5S)-2-pyrimidin-2-yl-2,7-diazaspiro[4.5]decan-7-yl]methanone
CID 3233034
[4-(4-Ethoxypyrimidin-2-yl)piperazin-1-yl]-pyridin-4-ylmethanone
CID 53579352
1-[4-(4-Ethoxypyrimidin-2-yl)piperazin-1-yl]-3-pyridin-4-ylpropan-1-one
CID 53588493
[4-(4-Ethoxypyrimidin-2-yl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 53591983
(4-(2-methyl-6-(1H-pyrrol-1-yl)pyrimidin-4-yl)piperazin-1-yl)(pyridin-3-yl)methanone
CID 71800051
2-(dimethylamino)-N-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-N-methylpyridine-3-carboxamide
CID 71935310

Frequently Asked Questions

What is the IUPAC name of [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone?
The IUPAC name of [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone (CID 118742924) is [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone.
What is the SMILES notation for [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone?
The canonical SMILES for [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone is COc1cc(N2CCC3(CCCN(C(=O)c4cccnc4)C3)C2)ncn1.
What is the InChIKey of [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone?
The InChIKey is ZPCMAVZIMSQKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-26-17-10-16(21-14-22-17)23-9-6-19(12-23)5-3-8-24(13-19)18(25)15-4-2-7-20-11-15/h2,4,7,10-11,14H,3,5-6,8-9,12-13H2,1H3.
What are the key properties of [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone?
[2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-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 [2-(6-methoxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-7-yl]-pyridin-3-ylmethanone is sourced from PubChem (CID 118742924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).