4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane

C17H30N2 — CID 65461677

IUPAC4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane
SMILESC1CCC2(CC1)CN(CC1CCC1)C(C1CC1)CN2
InChIInChI=1S/C17H30N2/c1-2-9-17(10-3-1)13-19(12-14-5-4-6-14)16(11-18-17)15-7-8-15/h14-16,18H,1-13H2
InChIKeyXISZIGQAGWWWLH-UHFFFAOYSA-N
MW262.44 g/mol
LogP3.17
Rot. Bonds3

About 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane

4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane (PubChem CID 65461677) has the molecular formula C17H30N2 and a molecular weight of 262.44 g/mol. Its IUPAC name is 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane
PubChem CID65461677
Molecular FormulaC17H30N2
Molecular Weight262.44 g/mol
Exact Mass262.24
IUPAC Name4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane
SMILESC1CCC2(CC1)CN(CC1CCC1)C(C1CC1)CN2
InChIInChI=1S/C17H30N2/c1-2-9-17(10-3-1)13-19(12-14-5-4-6-14)16(11-18-17)15-7-8-15/h14-16,18H,1-13H2
InChIKeyXISZIGQAGWWWLH-UHFFFAOYSA-N
XLogP3.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.44
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopropyl-4-(2-propoxyethyl)-1,4-diazaspiro[5.5]undecane
CID 106458748
2-cyclohexyl-1-(cyclopropylmethyl)-5,5-diethylpiperazine
CID 64860640
9-[(4-chlorophenyl)methyl]-8-cyclopropyl-6,9-diazaspiro[4.5]decane
CID 64877376
8-cyclopropyl-9-(pyrimidin-2-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64878339
8-cyclopropyl-9-(pyridin-4-ylmethyl)-6,9-diazaspiro[4.5]decane
CID 64877763
3-butan-2-yl-4-(cyclopropylmethyl)-1,4-diazaspiro[5.5]undecane
CID 64877428
3-cyclopropyl-4-[(1-methylpyrazol-3-yl)methyl]-1,4-diazaspiro[5.5]undecane
CID 82872339
8-cyclopropyl-9-[(2-methyltetrazol-5-yl)methyl]-6,9-diazaspiro[4.5]decane
CID 107055892
2,5-dicyclopropyl-1-(cyclopropylmethyl)-5-methylpiperazine
CID 64877328
9-[(4-bromothiophen-2-yl)methyl]-8-cyclopropyl-6,9-diazaspiro[4.5]decane
CID 64875648
8-cyclopropyl-9-[2-(2-methylpyrazol-3-yl)ethyl]-6,9-diazaspiro[4.5]decane
CID 103016553
3-ethyl-4-[(1-methylpiperidin-3-yl)methyl]-1,4-diazaspiro[5.5]undecane
CID 64946723

Frequently Asked Questions

What is the IUPAC name of 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane (CID 65461677) is 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane is C1CCC2(CC1)CN(CC1CCC1)C(C1CC1)CN2.
What is the InChIKey of 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane?
The InChIKey is XISZIGQAGWWWLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2/c1-2-9-17(10-3-1)13-19(12-14-5-4-6-14)16(11-18-17)15-7-8-15/h14-16,18H,1-13H2.
What are the key properties of 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane?
4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane has a molecular weight of 262.44 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclobutylmethyl)-3-cyclopropyl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 65461677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).