(5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one

C19H31N3O2 — CID 141301005

IUPAC(5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one
SMILESCC1CCN=C1N1CCC[C@@]2(CCN(C3CCC(O)CC3)C2=O)C1
InChIInChI=1S/C19H31N3O2/c1-14-7-10-20-17(14)21-11-2-8-19(13-21)9-12-22(18(19)24)15-3-5-16(23)6-4-15/h14-16,23H,2-13H2,1H3/t14?,15?,16?,19-/m1/s1
InChIKeyPEQFLIVGHVWZGI-ZEPBGEJQSA-N
MW333.48 g/mol
LogP2.04
Rot. Bonds1

About (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one

(5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one (PubChem CID 141301005) has the molecular formula C19H31N3O2 and a molecular weight of 333.48 g/mol. Its IUPAC name is (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name(5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one
PubChem CID141301005
Molecular FormulaC19H31N3O2
Molecular Weight333.48 g/mol
Exact Mass333.24
IUPAC Name(5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one
SMILESCC1CCN=C1N1CCC[C@@]2(CCN(C3CCC(O)CC3)C2=O)C1
InChIInChI=1S/C19H31N3O2/c1-14-7-10-20-17(14)21-11-2-8-19(13-21)9-12-22(18(19)24)15-3-5-16(23)6-4-15/h14-16,23H,2-13H2,1H3/t14?,15?,16?,19-/m1/s1
InChIKeyPEQFLIVGHVWZGI-ZEPBGEJQSA-N
XLogP2.04
TPSA56.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.48
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-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

(5R)-9-(3-bromo-5-methyl-2-pyridinyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 58653270
9-(2,3-difluorophenyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 66722474
N-[4-[(5R)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]phenyl]methanesulfonamide
CID 58653318
9-(5-fluoro-2-methylphenyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 66722375
(5R)-2-(4-hydroxycyclohexyl)-9-[5-(hydroxymethyl)-2-pyridinyl]-2,9-diazaspiro[4.5]decan-1-one
CID 58653425
(5S)-2-(4-hydroxycyclohexyl)-9-[3-(2-trimethylsilylethynyl)-2-pyridinyl]-2,9-diazaspiro[4.5]decan-1-one
CID 66722303
(5R)-2-(4-hydroxycyclohexyl)-9-[3-(2-trimethylsilylethynyl)-2-pyridinyl]-2,9-diazaspiro[4.5]decan-1-one
CID 69491493
(5R)-9-(3-bromo-5-fluoro-2-pyridinyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 58653472
[6-[2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-5-methyl-3-pyridinyl]-methylcarbamic acid
CID 66722459
[4-[(5S)-2-(4-hydroxycyclohexyl)-1-oxo-2,9-diazaspiro[4.5]decan-9-yl]-2-methylphenyl]-methylcarbamic acid
CID 66722332
(5R)-9-(5-amino-3-chloro-2-pyridinyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 67504327
9-(5-chloro-3-fluoro-2-pyridinyl)-2-(4-hydroxycyclohexyl)-2,9-diazaspiro[4.5]decan-1-one
CID 66722584

Frequently Asked Questions

What is the IUPAC name of (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one?
The IUPAC name of (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one (CID 141301005) is (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one?
The canonical SMILES for (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one is CC1CCN=C1N1CCC[C@@]2(CCN(C3CCC(O)CC3)C2=O)C1.
What is the InChIKey of (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one?
The InChIKey is PEQFLIVGHVWZGI-ZEPBGEJQSA-N. The full InChI is InChI=1S/C19H31N3O2/c1-14-7-10-20-17(14)21-11-2-8-19(13-21)9-12-22(18(19)24)15-3-5-16(23)6-4-15/h14-16,23H,2-13H2,1H3/t14?,15?,16?,19-/m1/s1.
What are the key properties of (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one?
(5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one has a molecular weight of 333.48 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-2-(4-hydroxycyclohexyl)-9-(4-methyl-3,4-dihydro-2H-pyrrol-5-yl)-2,9-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 141301005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).