(5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one

C19H24N2O2 — CID 164635054

IUPAC(5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one
SMILESO=C1CC[C@@]2(CCN(C(=O)C3(c4ccccc4)CCCC3)C2)N1
InChIInChI=1S/C19H24N2O2/c22-16-8-11-18(20-16)12-13-21(14-18)17(23)19(9-4-5-10-19)15-6-2-1-3-7-15/h1-3,6-7H,4-5,8-14H2,(H,20,22)/t18-/m0/s1
InChIKeyRMSSQIWPVVUHGU-SFHVURJKSA-N
MW312.41 g/mol
LogP2.38
Rot. Bonds2

About (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one

(5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one (PubChem CID 164635054) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one.

Molecular Properties

Compound Name(5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one
PubChem CID164635054
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name(5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one
SMILESO=C1CC[C@@]2(CCN(C(=O)C3(c4ccccc4)CCCC3)C2)N1
InChIInChI=1S/C19H24N2O2/c22-16-8-11-18(20-16)12-13-21(14-18)17(23)19(9-4-5-10-19)15-6-2-1-3-7-15/h1-3,6-7H,4-5,8-14H2,(H,20,22)/t18-/m0/s1
InChIKeyRMSSQIWPVVUHGU-SFHVURJKSA-N
XLogP2.38
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,7-diazaspiro[4.4]nonan-2-yl-(1-phenylcyclobutyl)methanone
CID 82038165
7-methyl-2-(1-phenylcyclopentanecarbonyl)-2,7-diazaspiro[4.5]decan-6-one
CID 72907513
3-(1-phenylcyclohexanecarbonyl)-7-oxa-3,11-diazaspiro[5.6]dodecan-10-one
CID 154819330
1'-(1-phenylcyclopentanecarbonyl)spiro[1,3-dihydroquinazoline-2,4'-piperidine]-4-one
CID 46950624
(1-phenylcyclobutyl)-piperazin-1-ylmethanone
CID 110463899
(1-phenylcyclopentyl)-(4-propan-2-ylpiperazin-1-yl)methanone
CID 135165735
(1-phenylcyclopentyl)-(4-phenylpiperazin-1-yl)methanone
CID 4048114
(1-phenylcyclopentyl)-[(11R)-11-phenyl-3,9-diazaspiro[5.5]undecan-3-yl]methanone
CID 151183103
3-methyl-1-(1-phenylcyclopropanecarbonyl)pyrrolidine-3-carboxylic acid
CID 63146569
7-(1-phenylcyclohexanecarbonyl)-2-propyl-2,7-diazaspiro[4.4]nonan-1-one
CID 175643999
[(3S)-3-hydroxy-3-(morpholin-4-ylmethyl)pyrrolidin-1-yl]-(1-phenylcyclopentyl)methanone
CID 124990656
(4R,5S)-4-(3-fluorophenyl)-2-(1-phenylcyclopentanecarbonyl)-2,6-diazaspiro[4.5]decan-7-one
CID 110148310

Frequently Asked Questions

What is the IUPAC name of (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one?
The IUPAC name of (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one (CID 164635054) is (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one.
What is the SMILES notation for (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one?
The canonical SMILES for (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one is O=C1CC[C@@]2(CCN(C(=O)C3(c4ccccc4)CCCC3)C2)N1.
What is the InChIKey of (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one?
The InChIKey is RMSSQIWPVVUHGU-SFHVURJKSA-N. The full InChI is InChI=1S/C19H24N2O2/c22-16-8-11-18(20-16)12-13-21(14-18)17(23)19(9-4-5-10-19)15-6-2-1-3-7-15/h1-3,6-7H,4-5,8-14H2,(H,20,22)/t18-/m0/s1.
What are the key properties of (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one?
(5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one has a molecular weight of 312.41 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-7-(1-phenylcyclopentanecarbonyl)-1,7-diazaspiro[4.4]nonan-2-one is sourced from PubChem (CID 164635054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).