[(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone

C20H34N2O2 — CID 164638779

IUPAC[(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone
SMILESCOC[C@H]1CN(C2CCC2)CC12CCN(C(=O)C1CCCC1)CC2
InChIInChI=1S/C20H34N2O2/c1-24-14-17-13-22(18-7-4-8-18)15-20(17)9-11-21(12-10-20)19(23)16-5-2-3-6-16/h16-18H,2-15H2,1H3/t17-/m1/s1
InChIKeyDXJFENMGXRBHNU-QGZVFWFLSA-N
MW334.50 g/mol
LogP2.92
Rot. Bonds4

About [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone

[(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone (PubChem CID 164638779) has the molecular formula C20H34N2O2 and a molecular weight of 334.50 g/mol. Its IUPAC name is [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone.

Molecular Properties

Compound Name[(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone
PubChem CID164638779
Molecular FormulaC20H34N2O2
Molecular Weight334.50 g/mol
Exact Mass334.26
IUPAC Name[(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone
SMILESCOC[C@H]1CN(C2CCC2)CC12CCN(C(=O)C1CCCC1)CC2
InChIInChI=1S/C20H34N2O2/c1-24-14-17-13-22(18-7-4-8-18)15-20(17)9-11-21(12-10-20)19(23)16-5-2-3-6-16/h16-18H,2-15H2,1H3/t17-/m1/s1
InChIKeyDXJFENMGXRBHNU-QGZVFWFLSA-N
XLogP2.92
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.50
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone?
The IUPAC name of [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone (CID 164638779) is [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone.
What is the SMILES notation for [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone?
The canonical SMILES for [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone is COC[C@H]1CN(C2CCC2)CC12CCN(C(=O)C1CCCC1)CC2.
What is the InChIKey of [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone?
The InChIKey is DXJFENMGXRBHNU-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H34N2O2/c1-24-14-17-13-22(18-7-4-8-18)15-20(17)9-11-21(12-10-20)19(23)16-5-2-3-6-16/h16-18H,2-15H2,1H3/t17-/m1/s1.
What are the key properties of [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone?
[(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone has a molecular weight of 334.50 g/mol, XLogP of 2.92, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-2-cyclobutyl-4-(methoxymethyl)-2,8-diazaspiro[4.5]decan-8-yl]-cyclopentylmethanone is sourced from PubChem (CID 164638779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).