4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane

C14H28N2 — CID 64877421

IUPAC4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane
SMILESCCCC1CNC2(CCCCC2)CN1CC
InChIInChI=1S/C14H28N2/c1-3-8-13-11-15-14(12-16(13)4-2)9-6-5-7-10-14/h13,15H,3-12H2,1-2H3
InChIKeyWRSHBYDFZGVYGB-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.78
Rot. Bonds3

About 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane

4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane (PubChem CID 64877421) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane
PubChem CID64877421
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane
SMILESCCCC1CNC2(CCCCC2)CN1CC
InChIInChI=1S/C14H28N2/c1-3-8-13-11-15-14(12-16(13)4-2)9-6-5-7-10-14/h13,15H,3-12H2,1-2H3
InChIKeyWRSHBYDFZGVYGB-UHFFFAOYSA-N
XLogP2.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-prop-2-enyl-3-propyl-1,4-diazaspiro[5.5]undecane
CID 64878190
9-heptyl-8-propyl-6,9-diazaspiro[4.5]decane
CID 64878326
3-propyl-4-(pyrimidin-2-ylmethyl)-1,4-diazaspiro[5.5]undecane
CID 64878189
9-benzyl-8-propyl-6,9-diazaspiro[4.5]decane
CID 64877176
9-ethyl-8-methyl-6,9-diazaspiro[4.5]decane
CID 64877161
4-[(1-methylpyrazol-4-yl)methyl]-3-propyl-1,4-diazaspiro[5.5]undecane
CID 64876848
4-[(1-methyltriazol-4-yl)methyl]-3-propyl-1,4-diazaspiro[5.5]undecane
CID 107055925
3-benzyl-4-ethyl-1,4-diazaspiro[5.5]undecane
CID 64877822
9-[(5-methyl-3-pyridinyl)methyl]-8-propyl-6,9-diazaspiro[4.5]decane
CID 102879622
9-(2-cyclohexylethyl)-8-ethyl-6,9-diazaspiro[4.5]decane
CID 64934961
8-ethyl-9-hexyl-6,9-diazaspiro[4.5]decane
CID 64878514
3-ethyl-4-(2-ethylsulfonylethyl)-1,4-diazaspiro[5.5]undecane
CID 106733186

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane (CID 64877421) is 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane is CCCC1CNC2(CCCCC2)CN1CC.
What is the InChIKey of 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane?
The InChIKey is WRSHBYDFZGVYGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-8-13-11-15-14(12-16(13)4-2)9-6-5-7-10-14/h13,15H,3-12H2,1-2H3.
What are the key properties of 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane?
4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane has a molecular weight of 224.39 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-propyl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 64877421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).