3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane

C17H32N2 — CID 79350283

IUPAC3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane
SMILESCC1CNC2(CCCCC2)CN1C1C(C)(C)C1(C)C
InChIInChI=1S/C17H32N2/c1-13-11-18-17(9-7-6-8-10-17)12-19(13)14-15(2,3)16(14,4)5/h13-14,18H,6-12H2,1-5H3
InChIKeyFZJFAVAQRQYABK-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.42
Rot. Bonds1

About 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane

3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane (PubChem CID 79350283) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane
PubChem CID79350283
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane
SMILESCC1CNC2(CCCCC2)CN1C1C(C)(C)C1(C)C
InChIInChI=1S/C17H32N2/c1-13-11-18-17(9-7-6-8-10-17)12-19(13)14-15(2,3)16(14,4)5/h13-14,18H,6-12H2,1-5H3
InChIKeyFZJFAVAQRQYABK-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-methyl-9-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-6,9-diazaspiro[4.5]decane
CID 64940112
8-propan-2-yl-9-(2,2,3,3-tetramethylcyclopropyl)-6,9-diazaspiro[4.5]decane
CID 79350195
8-methyl-9-(1-methylcyclopentyl)-6,9-diazaspiro[4.5]decane
CID 64939572
3-methyl-4-propan-2-yl-1,4-diazaspiro[5.5]undecane
CID 64877989
5-ethyl-2,5-dimethyl-1-(2,2,3,3-tetramethylcyclopropyl)piperazine
CID 79350282
4-(8-methyl-6,9-diazaspiro[4.5]decan-9-yl)thiane 1-oxide
CID 113480590
9-ethyl-8-methyl-6,9-diazaspiro[4.5]decane
CID 64877161
3-methyl-4-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64877798
4-(3-fluoropropyl)-3-methyl-1,4-diazaspiro[5.5]undecane
CID 81113962
3-methyl-4-(2-methylpentan-2-yl)-1,4-diazaspiro[5.5]undecane
CID 113472035
4-(3-ethylpentan-2-yl)-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64941030
8-methyl-9-(3-methylpentan-3-yl)-6,9-diazaspiro[4.5]decane
CID 114174386

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane (CID 79350283) is 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane is CC1CNC2(CCCCC2)CN1C1C(C)(C)C1(C)C.
What is the InChIKey of 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane?
The InChIKey is FZJFAVAQRQYABK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-13-11-18-17(9-7-6-8-10-17)12-19(13)14-15(2,3)16(14,4)5/h13-14,18H,6-12H2,1-5H3.
What are the key properties of 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane?
3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane has a molecular weight of 264.46 g/mol, XLogP of 3.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(2,2,3,3-tetramethylcyclopropyl)-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 79350283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).