4-(2-methylpropyl)-4-azaspiro[2.4]heptane

C10H19N — CID 177032629

IUPAC4-(2-methylpropyl)-4-azaspiro[2.4]heptane
SMILESCC(C)CN1CCCC12CC2
InChIInChI=1S/C10H19N/c1-9(2)8-11-7-3-4-10(11)5-6-10/h9H,3-8H2,1-2H3
InChIKeyDWVCUCBDQNUIGX-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.27
Rot. Bonds2

About 4-(2-methylpropyl)-4-azaspiro[2.4]heptane

4-(2-methylpropyl)-4-azaspiro[2.4]heptane (PubChem CID 177032629) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 4-(2-methylpropyl)-4-azaspiro[2.4]heptane.

Molecular Properties

Compound Name4-(2-methylpropyl)-4-azaspiro[2.4]heptane
PubChem CID177032629
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name4-(2-methylpropyl)-4-azaspiro[2.4]heptane
SMILESCC(C)CN1CCCC12CC2
InChIInChI=1S/C10H19N/c1-9(2)8-11-7-3-4-10(11)5-6-10/h9H,3-8H2,1-2H3
InChIKeyDWVCUCBDQNUIGX-UHFFFAOYSA-N
XLogP2.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
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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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpropyl)-4-azaspiro[2.4]heptane?
The IUPAC name of 4-(2-methylpropyl)-4-azaspiro[2.4]heptane (CID 177032629) is 4-(2-methylpropyl)-4-azaspiro[2.4]heptane.
What is the SMILES notation for 4-(2-methylpropyl)-4-azaspiro[2.4]heptane?
The canonical SMILES for 4-(2-methylpropyl)-4-azaspiro[2.4]heptane is CC(C)CN1CCCC12CC2.
What is the InChIKey of 4-(2-methylpropyl)-4-azaspiro[2.4]heptane?
The InChIKey is DWVCUCBDQNUIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-9(2)8-11-7-3-4-10(11)5-6-10/h9H,3-8H2,1-2H3.
What are the key properties of 4-(2-methylpropyl)-4-azaspiro[2.4]heptane?
4-(2-methylpropyl)-4-azaspiro[2.4]heptane has a molecular weight of 153.27 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpropyl)-4-azaspiro[2.4]heptane is sourced from PubChem (CID 177032629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).