(4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane

C20H36N2O2 — CID 124797230

IUPAC(4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane
SMILESCOCCN1C[C@H](COCC2CC2)C2(CCN(C3CCC3)CC2)C1
InChIInChI=1S/C20H36N2O2/c1-23-12-11-21-13-18(15-24-14-17-5-6-17)20(16-21)7-9-22(10-8-20)19-3-2-4-19/h17-19H,2-16H2,1H3/t18-/m1/s1
InChIKeyUXUGYURLLIEADA-GOSISDBHSA-N
MW336.52 g/mol
LogP2.63
Rot. Bonds8

About (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane

(4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane (PubChem CID 124797230) has the molecular formula C20H36N2O2 and a molecular weight of 336.52 g/mol. Its IUPAC name is (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name(4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane
PubChem CID124797230
Molecular FormulaC20H36N2O2
Molecular Weight336.52 g/mol
Exact Mass336.28
IUPAC Name(4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane
SMILESCOCCN1C[C@H](COCC2CC2)C2(CCN(C3CCC3)CC2)C1
InChIInChI=1S/C20H36N2O2/c1-23-12-11-21-13-18(15-24-14-17-5-6-17)20(16-21)7-9-22(10-8-20)19-3-2-4-19/h17-19H,2-16H2,1H3/t18-/m1/s1
InChIKeyUXUGYURLLIEADA-GOSISDBHSA-N
XLogP2.63
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.52
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane
CID 131655364
(4S,5R)-7-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(cyclopropylmethyl)-2,7-diazaspiro[4.4]nonane;bis(2,2,2-trifluoroacetic acid)
CID 155831538
4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-8-[(1-methylpyrazol-4-yl)methyl]-2,8-diazaspiro[4.5]decane;bis(2,2,2-trifluoroacetic acid)
CID 155863614
8-cyclobutyl-4-(methoxymethyl)-2-(oxan-4-ylmethyl)-2,8-diazaspiro[4.5]decane;bis(2,2,2-trifluoroacetic acid)
CID 155864495
cyclobutyl-[2-(2-methoxyethyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]methanone;2,2,2-trifluoroacetic acid
CID 155853117
1-[4-(cyclopropylmethoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-2-methoxyethanone
CID 131678283
2-[2-(2-methoxyethyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-5-methyl-1,3,4-thiadiazole
CID 131663345
8-(furan-3-ylmethyl)-2-(2-methoxyethyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decane
CID 131677243
1-cyclobutyl-4-(methoxymethyl)piperidine
CID 131107152
1-cyclopropyl-4-(2-methoxyethyl)piperazine
CID 153207861
(4R)-8-[(3-fluorophenyl)methyl]-2-(2-methoxyethyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decane
CID 124790564
8-[(1-ethylpyrazol-4-yl)methyl]-2-(2-methoxyethyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decane
CID 131678387

Frequently Asked Questions

What is the IUPAC name of (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane?
The IUPAC name of (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane (CID 124797230) is (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane?
The canonical SMILES for (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane is COCCN1C[C@H](COCC2CC2)C2(CCN(C3CCC3)CC2)C1.
What is the InChIKey of (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane?
The InChIKey is UXUGYURLLIEADA-GOSISDBHSA-N. The full InChI is InChI=1S/C20H36N2O2/c1-23-12-11-21-13-18(15-24-14-17-5-6-17)20(16-21)7-9-22(10-8-20)19-3-2-4-19/h17-19H,2-16H2,1H3/t18-/m1/s1.
What are the key properties of (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane?
(4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane has a molecular weight of 336.52 g/mol, XLogP of 2.63, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-8-cyclobutyl-4-(cyclopropylmethoxymethyl)-2-(2-methoxyethyl)-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 124797230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).