2-butyl-2-azaspiro[3.3]heptane

C10H19N — CID 170365296

IUPAC2-butyl-2-azaspiro[3.3]heptane
SMILESCCCCN1CC2(CCC2)C1
InChIInChI=1S/C10H19N/c1-2-3-7-11-8-10(9-11)5-4-6-10/h2-9H2,1H3
InChIKeyVVDAMXKBGNZJRV-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.27
Rot. Bonds3

About 2-butyl-2-azaspiro[3.3]heptane

2-butyl-2-azaspiro[3.3]heptane (PubChem CID 170365296) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 2-butyl-2-azaspiro[3.3]heptane.

Molecular Properties

Compound Name2-butyl-2-azaspiro[3.3]heptane
PubChem CID170365296
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name2-butyl-2-azaspiro[3.3]heptane
SMILESCCCCN1CC2(CCC2)C1
InChIInChI=1S/C10H19N/c1-2-3-7-11-8-10(9-11)5-4-6-10/h2-9H2,1H3
InChIKeyVVDAMXKBGNZJRV-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-butyl-5-azaspiro[2.5]octane
CID 130224729
2-butyl-2,6-diazaspiro[3.3]heptane
CID 159477315
2-ethyl-2-azaspiro[3.3]heptane
CID 130337259
6-butyl-2-oxa-6-azaspiro[3.3]heptane;methane
CID 176923726
5-(2-azaspiro[3.3]heptan-2-yl)pentan-2-one
CID 167476884
2-(3-propan-2-yloxypropyl)-2-azaspiro[3.3]heptane
CID 138616757
4-(2-azaspiro[3.3]heptan-2-yl)butanenitrile
CID 79686982
1-(2-butyl-2,7-diazaspiro[3.5]nonan-7-yl)propan-1-one;ethane
CID 170584310
2-(2-azaspiro[3.3]heptan-2-yl)ethanamine
CID 55289039
1-(2-hexyl-2,7-diazaspiro[3.5]nonan-7-yl)ethanone
CID 155455482
ethane;2-ethyl-7-pentyl-2,7-diazaspiro[3.5]nonane
CID 171554465
5-(2-azaspiro[3.5]nonan-2-yl)pentan-2-ol
CID 106131344

Frequently Asked Questions

What is the IUPAC name of 2-butyl-2-azaspiro[3.3]heptane?
The IUPAC name of 2-butyl-2-azaspiro[3.3]heptane (CID 170365296) is 2-butyl-2-azaspiro[3.3]heptane.
What is the SMILES notation for 2-butyl-2-azaspiro[3.3]heptane?
The canonical SMILES for 2-butyl-2-azaspiro[3.3]heptane is CCCCN1CC2(CCC2)C1.
What is the InChIKey of 2-butyl-2-azaspiro[3.3]heptane?
The InChIKey is VVDAMXKBGNZJRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-2-3-7-11-8-10(9-11)5-4-6-10/h2-9H2,1H3.
What are the key properties of 2-butyl-2-azaspiro[3.3]heptane?
2-butyl-2-azaspiro[3.3]heptane has a molecular weight of 153.27 g/mol, XLogP of 2.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-2-azaspiro[3.3]heptane is sourced from PubChem (CID 170365296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).