2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane

C12H18N4 — CID 171070249

IUPAC2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane
SMILESCN1CC2(CCN(c3ncccn3)CC2)C1
InChIInChI=1S/C12H18N4/c1-15-9-12(10-15)3-7-16(8-4-12)11-13-5-2-6-14-11/h2,5-6H,3-4,7-10H2,1H3
InChIKeyRZJGSHUIXVSJJS-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.01
Rot. Bonds1

About 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane

2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane (PubChem CID 171070249) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane.

Molecular Properties

Compound Name2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane
PubChem CID171070249
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane
SMILESCN1CC2(CCN(c3ncccn3)CC2)C1
InChIInChI=1S/C12H18N4/c1-15-9-12(10-15)3-7-16(8-4-12)11-13-5-2-6-14-11/h2,5-6H,3-4,7-10H2,1H3
InChIKeyRZJGSHUIXVSJJS-UHFFFAOYSA-N
XLogP1.01
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,8-di(pyrimidin-2-yl)-2,8-diazaspiro[4.5]decane
CID 97369995
methyl-(7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonan-2-yl)phosphane
CID 171070043
2-methyl-8-pyrimidin-2-yl-2,8-diazaspiro[4.5]decan-3-one
CID 175822956
ethane;2-(4-methylpiperazin-1-yl)pyrimidine
CID 143004762
2-pyrimidin-2-yl-2-azaspiro[3.3]heptane
CID 118413240
2-cyclopropylsulfonyl-8-pyrimidin-2-yl-2,8-diazaspiro[4.5]decane
CID 155902701
[2-(7-methyl-2,7-diazaspiro[4.4]nonan-2-yl)pyrimidin-4-yl]methanol
CID 175849457
(5S)-9-(6-methylpyridazin-3-yl)-2-pyrimidin-2-yl-2,9-diazaspiro[4.5]decane
CID 97484053
(5S)-9-(2-methoxyethyl)-2-pyrimidin-2-yl-2,9-diazaspiro[4.5]decane
CID 95713598
(5S)-2,10-di(pyrimidin-2-yl)-7-oxa-2,10-diazaspiro[4.6]undecane
CID 97385039
2-methyl-7-(5-methylpyrimidin-2-yl)-2,7-diazaspiro[4.5]decane
CID 118639949
1-methyl-4-pyrimidin-2-yl-1,4-diazepane;dihydrochloride
CID 122160375

Frequently Asked Questions

What is the IUPAC name of 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane?
The IUPAC name of 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane (CID 171070249) is 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane.
What is the SMILES notation for 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane?
The canonical SMILES for 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane is CN1CC2(CCN(c3ncccn3)CC2)C1.
What is the InChIKey of 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane?
The InChIKey is RZJGSHUIXVSJJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-15-9-12(10-15)3-7-16(8-4-12)11-13-5-2-6-14-11/h2,5-6H,3-4,7-10H2,1H3.
What are the key properties of 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane?
2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane has a molecular weight of 218.30 g/mol, XLogP of 1.01, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-7-pyrimidin-2-yl-2,7-diazaspiro[3.5]nonane is sourced from PubChem (CID 171070249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).