(3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane

C19H30N2O — CID 97475640

IUPAC(3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane
SMILESCOC[C@H]1CC2(CCN(CCc3ccccc3)CC2)CN1C
InChIInChI=1S/C19H30N2O/c1-20-16-19(14-18(20)15-22-2)9-12-21(13-10-19)11-8-17-6-4-3-5-7-17/h3-7,18H,8-16H2,1-2H3/t18-/m1/s1
InChIKeyIUWBHPGGRNFKEC-GOSISDBHSA-N
MW302.46 g/mol
LogP2.66
Rot. Bonds5

About (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane

(3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane (PubChem CID 97475640) has the molecular formula C19H30N2O and a molecular weight of 302.46 g/mol. Its IUPAC name is (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name(3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane
PubChem CID97475640
Molecular FormulaC19H30N2O
Molecular Weight302.46 g/mol
Exact Mass302.24
IUPAC Name(3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane
SMILESCOC[C@H]1CC2(CCN(CCc3ccccc3)CC2)CN1C
InChIInChI=1S/C19H30N2O/c1-20-16-19(14-18(20)15-22-2)9-12-21(13-10-19)11-8-17-6-4-3-5-7-17/h3-7,18H,8-16H2,1-2H3/t18-/m1/s1
InChIKeyIUWBHPGGRNFKEC-GOSISDBHSA-N
XLogP2.66
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-(methoxymethyl)-8-[(4-methoxyphenyl)methyl]-2-methyl-2,8-diazaspiro[4.5]decane
CID 97476268
(3R)-8-benzyl-3-(methoxymethyl)-2-methylsulfonyl-2,8-diazaspiro[4.5]decane
CID 97487642
8-[(3-fluorophenyl)methyl]-3-(methoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decane;bis(2,2,2-trifluoroacetic acid)
CID 155834191
5-(2-phenylethyl)-5-azaspiro[2.4]heptane
CID 142337171
(5S)-2-(2-methoxyethyl)-10-(2-phenylethyl)-7-oxa-2,10-diazaspiro[4.6]undecane
CID 97472054
2-acetyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 70719914
1-[(3S)-3-(methoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-3-phenoxypropan-1-one
CID 97475871
1-[3-(methoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decan-8-yl]-2-phenoxyethanone;2,2,2-trifluoroacetic acid
CID 155830450
8-(1,3-benzodioxol-5-ylmethyl)-3-(methoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decane;bis(2,2,2-trifluoroacetic acid)
CID 155833070
(3R)-3-(methoxymethyl)-2-methyl-8-(3-methylphenyl)sulfonyl-2,8-diazaspiro[4.5]decane
CID 97482562
(4R)-1-ethyl-7-(2-phenylethyl)-1,7-diazaspiro[3.4]octane
CID 97397493
3-(methoxymethyl)-2-methyl-8-pyridin-3-ylsulfonyl-2,8-diazaspiro[4.5]decane
CID 131648490

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane?
The IUPAC name of (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane (CID 97475640) is (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane?
The canonical SMILES for (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane is COC[C@H]1CC2(CCN(CCc3ccccc3)CC2)CN1C.
What is the InChIKey of (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane?
The InChIKey is IUWBHPGGRNFKEC-GOSISDBHSA-N. The full InChI is InChI=1S/C19H30N2O/c1-20-16-19(14-18(20)15-22-2)9-12-21(13-10-19)11-8-17-6-4-3-5-7-17/h3-7,18H,8-16H2,1-2H3/t18-/m1/s1.
What are the key properties of (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane?
(3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane has a molecular weight of 302.46 g/mol, XLogP of 2.66, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(methoxymethyl)-2-methyl-8-(2-phenylethyl)-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 97475640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).