8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane

C19H25N5 — CID 97449503

IUPAC8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane
SMILESCc1cccc(CN2CCC3(CC2)CCN(c2ncccn2)C3)n1
InChIInChI=1S/C19H25N5/c1-16-4-2-5-17(22-16)14-23-11-6-19(7-12-23)8-13-24(15-19)18-20-9-3-10-21-18/h2-5,9-10H,6-8,11-15H2,1H3
InChIKeyYLYDMIVGSNDCEF-UHFFFAOYSA-N
MW323.44 g/mol
LogP2.67
Rot. Bonds3

About 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane

8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane (PubChem CID 97449503) has the molecular formula C19H25N5 and a molecular weight of 323.44 g/mol. Its IUPAC name is 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane
PubChem CID97449503
Molecular FormulaC19H25N5
Molecular Weight323.44 g/mol
Exact Mass323.21
IUPAC Name8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane
SMILESCc1cccc(CN2CCC3(CC2)CCN(c2ncccn2)C3)n1
InChIInChI=1S/C19H25N5/c1-16-4-2-5-17(22-16)14-23-11-6-19(7-12-23)8-13-24(15-19)18-20-9-3-10-21-18/h2-5,9-10H,6-8,11-15H2,1H3
InChIKeyYLYDMIVGSNDCEF-UHFFFAOYSA-N
XLogP2.67
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-methyl-2-pyridinyl)methyl]-9-pyrimidin-2-yl-2,9-diazaspiro[5.5]undecane
CID 97393864
1-[(6-methyl-2-pyridinyl)methyl]-4-pyrimidin-2-yl-1,4-diazepane
CID 95811450
2-(5-ethylpyrimidin-2-yl)-8-(pyridin-2-ylmethyl)-2,8-diazaspiro[4.5]decane
CID 98587801
2,8-di(pyrimidin-2-yl)-2,8-diazaspiro[4.5]decane
CID 97369995
8-[(6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-1-one
CID 97449681
(3S)-8-[(6-methyl-2-pyridinyl)methyl]-2-propyl-2,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 95897636
(5R)-2-(2-fluoroethyl)-7-[(6-methyl-2-pyridinyl)methyl]-2,7-diazaspiro[4.5]decane
CID 97483305
4-[7-[(6-methyl-2-pyridinyl)methyl]-7-azaspiro[3.5]nonan-2-yl]morpholine
CID 97451178
1-[(3R)-3-(hydroxymethyl)-3-methyl-8-[(6-methyl-2-pyridinyl)methyl]-2,8-diazaspiro[4.5]decan-2-yl]ethanone
CID 124966320
2-[(4-methoxyphenyl)methyl]-8-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane
CID 97449653
(3S)-8-[(6-methyl-2-pyridinyl)methyl]-3-(pyridin-3-yloxymethyl)-2-oxa-8-azaspiro[4.5]decane
CID 97418316
3-methyl-1-[(6-methyl-2-pyridinyl)methyl]pyrrolidine-3-carboxylic acid
CID 79261129

Frequently Asked Questions

What is the IUPAC name of 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane (CID 97449503) is 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane is Cc1cccc(CN2CCC3(CC2)CCN(c2ncccn2)C3)n1.
What is the InChIKey of 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane?
The InChIKey is YLYDMIVGSNDCEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5/c1-16-4-2-5-17(22-16)14-23-11-6-19(7-12-23)8-13-24(15-19)18-20-9-3-10-21-18/h2-5,9-10H,6-8,11-15H2,1H3.
What are the key properties of 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane?
8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane has a molecular weight of 323.44 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(6-methyl-2-pyridinyl)methyl]-2-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 97449503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).