1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane

C12H22N2 — CID 58546878

IUPAC1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane
SMILESC=C1NCCC12CCN(C(C)C)CC2
InChIInChI=1S/C12H22N2/c1-10(2)14-8-5-12(6-9-14)4-7-13-11(12)3/h10,13H,3-9H2,1-2H3
InChIKeyBLQWPFRZGIMXSV-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.98
Rot. Bonds1

About 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane

1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane (PubChem CID 58546878) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane
PubChem CID58546878
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane
SMILESC=C1NCCC12CCN(C(C)C)CC2
InChIInChI=1S/C12H22N2/c1-10(2)14-8-5-12(6-9-14)4-7-13-11(12)3/h10,13H,3-9H2,1-2H3
InChIKeyBLQWPFRZGIMXSV-UHFFFAOYSA-N
XLogP1.98
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane (CID 58546878) is 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane is C=C1NCCC12CCN(C(C)C)CC2.
What is the InChIKey of 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane?
The InChIKey is BLQWPFRZGIMXSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-10(2)14-8-5-12(6-9-14)4-7-13-11(12)3/h10,13H,3-9H2,1-2H3.
What are the key properties of 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane?
1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane has a molecular weight of 194.32 g/mol, XLogP of 1.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylidene-8-propan-2-yl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 58546878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).