2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane

C15H27N — CID 171656955

IUPAC2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane
SMILESCCC1CC2(CCN(CC3(C)CC3)CC2)C1
InChIInChI=1S/C15H27N/c1-3-13-10-15(11-13)6-8-16(9-7-15)12-14(2)4-5-14/h13H,3-12H2,1-2H3
InChIKeySHDYURWBOMPHQD-UHFFFAOYSA-N
MW221.39 g/mol
LogP3.69
Rot. Bonds3

About 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane

2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane (PubChem CID 171656955) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane
PubChem CID171656955
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC Name2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane
SMILESCCC1CC2(CCN(CC3(C)CC3)CC2)C1
InChIInChI=1S/C15H27N/c1-3-13-10-15(11-13)6-8-16(9-7-15)12-14(2)4-5-14/h13H,3-12H2,1-2H3
InChIKeySHDYURWBOMPHQD-UHFFFAOYSA-N
XLogP3.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-7-(2-methoxyethyl)-7-azaspiro[3.5]nonane
CID 177319164
2-ethylspiro[3.3]heptane
CID 123395058
2-ethyl-6-(3,3,3-trifluoropropyl)-6-azaspiro[3.4]octane
CID 170739932
[1-[(2-ethyl-7-azaspiro[3.5]nonan-7-yl)methyl]cyclopropyl]methyl ethanimidate
CID 171657544
7-butan-2-yl-2-ethyl-7-azaspiro[3.5]nonane;ethane
CID 176986311
7-propyl-7-azaspiro[3.5]nonan-2-amine
CID 146389071
4-(2-ethyl-7-azaspiro[3.5]nonan-7-yl)-2-(methylamino)butanoic acid
CID 144515785
2-ethyl-7-propan-2-ylsulfonyl-7-azaspiro[3.5]nonane
CID 175627410
2-(bromomethyl)-6-ethyl-6-azaspiro[3.4]octane
CID 71635297
2-[1-[(1-methylcyclopropyl)methyl]piperidin-4-yl]ethanol
CID 166141791
(5S,8R)-2-ethyl-2-azaspiro[4.4]nonan-8-amine
CID 98084994
(3S)-1-[(1-methylcyclopropyl)methyl]pyrrolidin-3-amine
CID 130875890

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane?
The IUPAC name of 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane (CID 171656955) is 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane.
What is the SMILES notation for 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane?
The canonical SMILES for 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane is CCC1CC2(CCN(CC3(C)CC3)CC2)C1.
What is the InChIKey of 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane?
The InChIKey is SHDYURWBOMPHQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N/c1-3-13-10-15(11-13)6-8-16(9-7-15)12-14(2)4-5-14/h13H,3-12H2,1-2H3.
What are the key properties of 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane?
2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane has a molecular weight of 221.39 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-7-[(1-methylcyclopropyl)methyl]-7-azaspiro[3.5]nonane is sourced from PubChem (CID 171656955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).