[(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone

C17H30N2O3 — CID 124822752

IUPAC[(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone
SMILESCC(C)N1CCOC[C@]2(CCCN(C(=O)[C@H]3CCCO3)C2)C1
InChIInChI=1S/C17H30N2O3/c1-14(2)18-8-10-21-13-17(11-18)6-4-7-19(12-17)16(20)15-5-3-9-22-15/h14-15H,3-13H2,1-2H3/t15-,17-/m1/s1
InChIKeyWPTSUELBQZMRJY-NVXWUHKLSA-N
MW310.44 g/mol
LogP1.51
Rot. Bonds2

About [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone

[(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone (PubChem CID 124822752) has the molecular formula C17H30N2O3 and a molecular weight of 310.44 g/mol. Its IUPAC name is [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone.

Molecular Properties

Compound Name[(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone
PubChem CID124822752
Molecular FormulaC17H30N2O3
Molecular Weight310.44 g/mol
Exact Mass310.23
IUPAC Name[(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone
SMILESCC(C)N1CCOC[C@]2(CCCN(C(=O)[C@H]3CCCO3)C2)C1
InChIInChI=1S/C17H30N2O3/c1-14(2)18-8-10-21-13-17(11-18)6-4-7-19(12-17)16(20)15-5-3-9-22-15/h14-15H,3-13H2,1-2H3/t15-,17-/m1/s1
InChIKeyWPTSUELBQZMRJY-NVXWUHKLSA-N
XLogP1.51
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[(6R)-11-(cyclopropylmethyl)-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]-[(2S)-oxolan-2-yl]methanone
CID 97494457
[(2R)-oxolan-2-yl]-[(6S)-11-phenyl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone
CID 97494631
[(2S)-oxolan-2-yl]-[(6S)-11-pyrimidin-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone
CID 97398115
2-oxa-7-azaspiro[3.5]nonan-7-yl(oxolan-2-yl)methanone
CID 131655037
(11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl)-quinolin-3-ylmethanone
CID 131657267
(1-fluorocyclobutyl)-(11-propan-2-yl-8-oxa-3,11-diazaspiro[5.6]dodecan-3-yl)methanone
CID 131685131
1-[(6S)-4-[(2R)-oxolane-2-carbonyl]-1-oxa-4,8-diazaspiro[5.5]undecan-8-yl]ethanone
CID 95043174
oxolan-2-yl-[3-(4-propan-2-ylpiperazin-1-yl)azetidin-1-yl]methanone
CID 126892184
[2-(2-oxa-8-azaspiro[3.5]nonane-8-carbonyl)cyclobutyl]-(2-oxa-8-azaspiro[3.5]nonan-8-yl)methanone
CID 155955717
3-ethyl-1-[(2S)-oxolane-2-carbonyl]pyrrolidine-3-carboxylic acid
CID 104855679
(2,2-dimethylmorpholin-4-yl)-(oxolan-2-yl)methanone
CID 51078971
[(2S)-oxolan-2-yl]-[(4S)-4-propan-2-ylazepan-1-yl]methanone
CID 95627899

Frequently Asked Questions

What is the IUPAC name of [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone?
The IUPAC name of [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone (CID 124822752) is [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone.
What is the SMILES notation for [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone?
The canonical SMILES for [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone is CC(C)N1CCOC[C@]2(CCCN(C(=O)[C@H]3CCCO3)C2)C1.
What is the InChIKey of [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone?
The InChIKey is WPTSUELBQZMRJY-NVXWUHKLSA-N. The full InChI is InChI=1S/C17H30N2O3/c1-14(2)18-8-10-21-13-17(11-18)6-4-7-19(12-17)16(20)15-5-3-9-22-15/h14-15H,3-13H2,1-2H3/t15-,17-/m1/s1.
What are the key properties of [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone?
[(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone has a molecular weight of 310.44 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-oxolan-2-yl]-[(6R)-11-propan-2-yl-8-oxa-2,11-diazaspiro[5.6]dodecan-2-yl]methanone is sourced from PubChem (CID 124822752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).