N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide

C15H27NO5S — CID 154789497

IUPACN-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide
SMILESCOC1(CS(=O)(=O)N[C@@H]2C[C@@H](O)C23CCOCC3)CCCC1
InChIInChI=1S/C15H27NO5S/c1-20-14(4-2-3-5-14)11-22(18,19)16-12-10-13(17)15(12)6-8-21-9-7-15/h12-13,16-17H,2-11H2,1H3/t12-,13-/m1/s1
InChIKeyVGDVFSOPLOZVAM-CHWSQXEVSA-N
MW333.45 g/mol
LogP0.80
Rot. Bonds5

About N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide

N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide (PubChem CID 154789497) has the molecular formula C15H27NO5S and a molecular weight of 333.45 g/mol. Its IUPAC name is N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide.

Molecular Properties

Compound NameN-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide
PubChem CID154789497
Molecular FormulaC15H27NO5S
Molecular Weight333.45 g/mol
Exact Mass333.16
IUPAC NameN-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide
SMILESCOC1(CS(=O)(=O)N[C@@H]2C[C@@H](O)C23CCOCC3)CCCC1
InChIInChI=1S/C15H27NO5S/c1-20-14(4-2-3-5-14)11-22(18,19)16-12-10-13(17)15(12)6-8-21-9-7-15/h12-13,16-17H,2-11H2,1H3/t12-,13-/m1/s1
InChIKeyVGDVFSOPLOZVAM-CHWSQXEVSA-N
XLogP0.80
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.45
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide 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

N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-3-methylbutanamide
CID 165457001
2-(dimethylamino)-N-[(1S,3S)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]acetamide
CID 178190778
2-cyclopropyl-N-[(1S,3S)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]acetamide
CID 178190775
N-cyclopentyl-2-[[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]amino]acetamide
CID 136585794
(1-methoxycyclohexyl)methanesulfonamide
CID 131186704
(1S,3R)-3-ethoxy-7-oxaspiro[3.5]nonan-1-ol
CID 97300107
(1R,3R)-3-ethoxy-7-oxaspiro[3.5]nonan-1-ol
CID 97300110
N-[(1-methoxycyclobutyl)methyl]-1-(oxan-4-yl)methanamine
CID 103991529
(1R,3R)-1-[[1-[(4-methoxyphenyl)methyl]tetrazol-5-yl]amino]-7-oxaspiro[3.5]nonan-3-ol
CID 167789226
2-(4-methoxyoxan-4-yl)acetic acid
CID 84654866
N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-5-methyl-1,3-oxazole-2-carboxamide
CID 154767484
(1R,3R)-1-[(4-propan-2-yloxypyrimidin-2-yl)amino]-7-oxaspiro[3.5]nonan-3-ol
CID 167870410

Frequently Asked Questions

What is the IUPAC name of N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide?
The IUPAC name of N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide (CID 154789497) is N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide.
What is the SMILES notation for N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide?
The canonical SMILES for N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide is COC1(CS(=O)(=O)N[C@@H]2C[C@@H](O)C23CCOCC3)CCCC1.
What is the InChIKey of N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide?
The InChIKey is VGDVFSOPLOZVAM-CHWSQXEVSA-N. The full InChI is InChI=1S/C15H27NO5S/c1-20-14(4-2-3-5-14)11-22(18,19)16-12-10-13(17)15(12)6-8-21-9-7-15/h12-13,16-17H,2-11H2,1H3/t12-,13-/m1/s1.
What are the key properties of N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide?
N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide has a molecular weight of 333.45 g/mol, XLogP of 0.80, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,3R)-3-hydroxy-7-oxaspiro[3.5]nonan-1-yl]-1-(1-methoxycyclopentyl)methanesulfonamide is sourced from PubChem (CID 154789497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).