(4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one

C20H28N2O2 — CID 97384049

IUPAC(4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one
SMILESO=C1C[C@H](c2ccccc2)C2(CCN(CC3CCOCC3)CC2)N1
InChIInChI=1S/C20H28N2O2/c23-19-14-18(17-4-2-1-3-5-17)20(21-19)8-10-22(11-9-20)15-16-6-12-24-13-7-16/h1-5,16,18H,6-15H2,(H,21,23)/t18-/m1/s1
InChIKeyJPFBIHTXYXYKCN-GOSISDBHSA-N
MW328.46 g/mol
LogP2.55
Rot. Bonds3

About (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one

(4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one (PubChem CID 97384049) has the molecular formula C20H28N2O2 and a molecular weight of 328.46 g/mol. Its IUPAC name is (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name(4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one
PubChem CID97384049
Molecular FormulaC20H28N2O2
Molecular Weight328.46 g/mol
Exact Mass328.22
IUPAC Name(4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one
SMILESO=C1C[C@H](c2ccccc2)C2(CCN(CC3CCOCC3)CC2)N1
InChIInChI=1S/C20H28N2O2/c23-19-14-18(17-4-2-1-3-5-17)20(21-19)8-10-22(11-9-20)15-16-6-12-24-13-7-16/h1-5,16,18H,6-15H2,(H,21,23)/t18-/m1/s1
InChIKeyJPFBIHTXYXYKCN-GOSISDBHSA-N
XLogP2.55
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.46
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(4R)-8-(oxane-4-carbonyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one
CID 97469703
(4S)-8-[(2-methyl-1,3-thiazol-4-yl)methyl]-4-phenyl-1,8-diazaspiro[4.5]decan-2-one
CID 97469660
(4S)-8-[(3R)-oxolane-3-carbonyl]-4-pyridin-3-yl-1,8-diazaspiro[4.5]decan-2-one
CID 97391774
(4S)-8-[(3S)-oxolane-3-carbonyl]-4-pyridin-3-yl-1,8-diazaspiro[4.5]decan-2-one
CID 97391776
(4R)-8-(6-methylpyridazin-3-yl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one
CID 97469671
(4S)-8-[(4-fluorophenyl)methyl]-4-pyridin-3-yl-1,8-diazaspiro[4.5]decan-2-one
CID 97384074
8-(2-methoxyethyl)-4-pyridin-3-yl-1,8-diazaspiro[4.5]decan-2-one
CID 134074654
1-methyl-8-(oxolan-3-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one;2,2,2-trifluoroacetic acid
CID 155853634
8-[(5-methylthiophen-2-yl)methyl]-4-pyridin-3-yl-1,8-diazaspiro[4.5]decan-2-one
CID 131656109
(4R)-8-[(3R)-oxolane-3-carbonyl]-4-pyridin-4-yl-1,8-diazaspiro[4.5]decan-2-one
CID 97470037
8-(furan-3-ylmethyl)-4-pyridin-4-yl-1,8-diazaspiro[4.5]decan-2-one
CID 131646046
1'-(oxan-4-ylmethyl)spiro[3,4-dihydro-2H-isoquinoline-1,4'-piperidine]
CID 121359677

Frequently Asked Questions

What is the IUPAC name of (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one?
The IUPAC name of (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one (CID 97384049) is (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one?
The canonical SMILES for (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one is O=C1C[C@H](c2ccccc2)C2(CCN(CC3CCOCC3)CC2)N1.
What is the InChIKey of (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one?
The InChIKey is JPFBIHTXYXYKCN-GOSISDBHSA-N. The full InChI is InChI=1S/C20H28N2O2/c23-19-14-18(17-4-2-1-3-5-17)20(21-19)8-10-22(11-9-20)15-16-6-12-24-13-7-16/h1-5,16,18H,6-15H2,(H,21,23)/t18-/m1/s1.
What are the key properties of (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one?
(4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one has a molecular weight of 328.46 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-8-(oxan-4-ylmethyl)-4-phenyl-1,8-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 97384049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).