ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane

C14H29N — CID 177021220

IUPACethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane
SMILESCC.CC(C)CC1CCC2(CC1)CNC2
InChIInChI=1S/C12H23N.C2H6/c1-10(2)7-11-3-5-12(6-4-11)8-13-9-12;1-2/h10-11,13H,3-9H2,1-2H3;1-2H3
InChIKeyNDUMWYXEAIVJIC-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.84
Rot. Bonds2

About ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane

ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane (PubChem CID 177021220) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane.

Molecular Properties

Compound Nameethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane
PubChem CID177021220
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Nameethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane
SMILESCC.CC(C)CC1CCC2(CC1)CNC2
InChIInChI=1S/C12H23N.C2H6/c1-10(2)7-11-3-5-12(6-4-11)8-13-9-12;1-2/h10-11,13H,3-9H2,1-2H3;1-2H3
InChIKeyNDUMWYXEAIVJIC-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;7-ethyl-2-azaspiro[3.5]nonane
CID 171834454
2-methyl-7-(2-methylpropyl)-2-azaspiro[3.5]nonane
CID 176651901
7-(2-methylpropyl)-2-azaspiro[3.3]heptane
CID 155087784
1,1-di(cyclobutyl)-4-(2-methylpropyl)cyclohexane
CID 139971599
6-(2-methylpropyl)-2λ6-thiaspiro[3.4]octane 2,2-dioxide
CID 146652162
bis(2-methylpropylcyclohexane);2-methylpropylcyclopentane
CID 159474199
2-methylpropylcyclopentane;2-methylpropylcyclopropane
CID 159402972
methane;2-methylpropylcyclopentane
CID 161254337
trans-(2R,4S)-1,1-difluoro-2-methyl-4-(2-methylpropyl)cyclohexane
CID 121406270
N-[(4,4-difluorocyclohexyl)methyl]-4-(2-methylpropyl)cyclohexan-1-amine
CID 177148483
2-methylpropylcyclohexane;2-methylpropylcyclopentane;2-methylpropylcyclopropane
CID 159692112
cyclopentane;iron;2-methylpropylcyclopentane
CID 172726896

Frequently Asked Questions

What is the IUPAC name of ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane?
The IUPAC name of ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane (CID 177021220) is ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane.
What is the SMILES notation for ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane?
The canonical SMILES for ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane is CC.CC(C)CC1CCC2(CC1)CNC2.
What is the InChIKey of ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane?
The InChIKey is NDUMWYXEAIVJIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N.C2H6/c1-10(2)7-11-3-5-12(6-4-11)8-13-9-12;1-2/h10-11,13H,3-9H2,1-2H3;1-2H3.
What are the key properties of ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane?
ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane has a molecular weight of 211.39 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-(2-methylpropyl)-2-azaspiro[3.5]nonane is sourced from PubChem (CID 177021220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).