2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one

C20H33N3O2 — CID 11695946

IUPAC2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one
SMILESO=C(N1CCCCC1)N1CCCC2(CCN(C3CCCCC3)C2=O)C1
InChIInChI=1S/C20H33N3O2/c24-18-20(11-15-23(18)17-8-3-1-4-9-17)10-7-14-22(16-20)19(25)21-12-5-2-6-13-21/h17H,1-16H2
InChIKeyPZLXJCCGKZAZQQ-UHFFFAOYSA-N
MW347.50 g/mol
LogP3.24
Rot. Bonds1

About 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one

2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one (PubChem CID 11695946) has the molecular formula C20H33N3O2 and a molecular weight of 347.50 g/mol. Its IUPAC name is 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one.

Molecular Properties

Compound Name2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one
PubChem CID11695946
Molecular FormulaC20H33N3O2
Molecular Weight347.50 g/mol
Exact Mass347.26
IUPAC Name2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one
SMILESO=C(N1CCCCC1)N1CCCC2(CCN(C3CCCCC3)C2=O)C1
InChIInChI=1S/C20H33N3O2/c24-18-20(11-15-23(18)17-8-3-1-4-9-17)10-7-14-22(16-20)19(25)21-12-5-2-6-13-21/h17H,1-16H2
InChIKeyPZLXJCCGKZAZQQ-UHFFFAOYSA-N
XLogP3.24
TPSA43.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.50
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-Cyclopentyl-2-[(4-methylpiperazin-1-yl)carbonyl]-2,7-diazaspiro[4.5]decan-6-one
CID 72918288
2-Cyclohexyl-9-(pyrrolidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one
CID 11631360
2-Cyclohexyl-8-(piperidine-1-carbonyl)-2,8-diazaspiro[4.5]decan-1-one
CID 16739474
9-Cyclohexyl-2-methyl-2,9-diazaspiro[4.5]decan-1-one;methane
CID 160360025
(5S)-7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide
CID 42244172
(5R)-7-(cyclohexylmethyl)-6-oxo-N-propan-2-yl-2,7-diazaspiro[4.5]decane-2-carboxamide
CID 42244173
1-[(5R)-9-(cyclohexylmethyl)-2,9-diazaspiro[4.5]decan-2-yl]-2-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 42288761
1-[(5S)-9-(cyclohexylmethyl)-2,9-diazaspiro[4.5]decan-2-yl]-2-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 42288763
7-(Cyclohexylmethyl)-2-[(1-isopropyl-4-piperidinyl)acetyl]-2,7-diazaspiro[4.5]decane
CID 45180656
4-{[7-(cyclohexylmethyl)-2,7-diazaspiro[4.5]dec-2-yl]carbonyl}-N,N-dimethyl-1-piperidinecarboxamide
CID 45193025
2-(1-Acetylpiperidin-4-yl)-7-(cyclohexylmethyl)-2,7-diazaspiro[4.5]decan-6-one
CID 45228619
7-(Cyclohexylmethyl)-N-isopropyl-6-oxo-2,7-diazaspiro[4.5]decane-2-carboxamide
CID 45237561

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one?
The IUPAC name of 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one (CID 11695946) is 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one.
What is the SMILES notation for 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one?
The canonical SMILES for 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one is O=C(N1CCCCC1)N1CCCC2(CCN(C3CCCCC3)C2=O)C1.
What is the InChIKey of 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one?
The InChIKey is PZLXJCCGKZAZQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N3O2/c24-18-20(11-15-23(18)17-8-3-1-4-9-17)10-7-14-22(16-20)19(25)21-12-5-2-6-13-21/h17H,1-16H2.
What are the key properties of 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one?
2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one has a molecular weight of 347.50 g/mol, XLogP of 3.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-9-(piperidine-1-carbonyl)-2,9-diazaspiro[4.5]decan-1-one is sourced from PubChem (CID 11695946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).