(8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane

C19H28N2O2 — CID 124790661

IUPAC(8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane
SMILESCc1ccncc1CO[C@H]1CCOC2(C1)CN(C1CCCC1)C2
InChIInChI=1S/C19H28N2O2/c1-15-6-8-20-11-16(15)12-22-18-7-9-23-19(10-18)13-21(14-19)17-4-2-3-5-17/h6,8,11,17-18H,2-5,7,9-10,12-14H2,1H3/t18-/m0/s1
InChIKeyOOEYPNPAYBRWON-SFHVURJKSA-N
MW316.44 g/mol
LogP3.08
Rot. Bonds4

About (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane

(8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane (PubChem CID 124790661) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane.

Molecular Properties

Compound Name(8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane
PubChem CID124790661
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC Name(8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane
SMILESCc1ccncc1CO[C@H]1CCOC2(C1)CN(C1CCCC1)C2
InChIInChI=1S/C19H28N2O2/c1-15-6-8-20-11-16(15)12-22-18-7-9-23-19(10-18)13-21(14-19)17-4-2-3-5-17/h6,8,11,17-18H,2-5,7,9-10,12-14H2,1H3/t18-/m0/s1
InChIKeyOOEYPNPAYBRWON-SFHVURJKSA-N
XLogP3.08
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane with MolForge

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Launch Full Analysis

Related Compounds

1-[8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]pentan-1-one
CID 131692798
(8S)-2-[(2,5-dimethylpyrazol-3-yl)methyl]-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane
CID 124806846
2-[(2-methoxy-3-pyridinyl)methyl]-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane
CID 133137575
1H-indol-2-yl-[8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone
CID 131695270
2-(oxan-4-yl)-8-(pyridin-2-ylmethoxy)-5-oxa-2-azaspiro[3.5]nonane
CID 131648833
(3,5-dimethylphenyl)-[(8R)-8-(pyridin-4-ylmethoxy)-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone
CID 124793361
(8S)-2-(furan-2-ylmethyl)-8-(pyridin-3-ylmethoxy)-5-oxa-2-azaspiro[3.5]nonane
CID 124804079
(8S)-2-(5-methyl-1,3,4-thiadiazol-2-yl)-8-(pyridin-4-ylmethoxy)-5-oxa-2-azaspiro[3.5]nonane
CID 124806524
2-(4-methylphenyl)-1-[(8R)-8-(pyridin-3-ylmethoxy)-5-oxa-2-azaspiro[3.5]nonan-2-yl]ethanone
CID 124796331
(8S)-2-[(1-methylpyrazol-4-yl)methyl]-8-(pyridin-4-ylmethoxy)-5-oxa-2-azaspiro[3.5]nonane
CID 124815514
(8R)-2-[(1-methylpyrazol-4-yl)methyl]-8-(pyridin-4-ylmethoxy)-5-oxa-2-azaspiro[3.5]nonane
CID 124815516
(8S)-8-(4-methylpyrimidin-2-yl)oxy-2-(oxan-4-yl)-5-oxa-2-azaspiro[3.5]nonane
CID 124893559

Frequently Asked Questions

What is the IUPAC name of (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane?
The IUPAC name of (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane (CID 124790661) is (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane.
What is the SMILES notation for (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane?
The canonical SMILES for (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane is Cc1ccncc1CO[C@H]1CCOC2(C1)CN(C1CCCC1)C2.
What is the InChIKey of (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane?
The InChIKey is OOEYPNPAYBRWON-SFHVURJKSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-15-6-8-20-11-16(15)12-22-18-7-9-23-19(10-18)13-21(14-19)17-4-2-3-5-17/h6,8,11,17-18H,2-5,7,9-10,12-14H2,1H3/t18-/m0/s1.
What are the key properties of (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane?
(8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane has a molecular weight of 316.44 g/mol, XLogP of 3.08, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-2-cyclopentyl-8-[(4-methyl-3-pyridinyl)methoxy]-5-oxa-2-azaspiro[3.5]nonane is sourced from PubChem (CID 124790661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).