N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide

C14H26N2O3S — CID 97420147

IUPACN-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide
SMILESCC(C)N1CC[C@@]2(C[C@H](NS(=O)(=O)C3CC3)CCO2)C1
InChIInChI=1S/C14H26N2O3S/c1-11(2)16-7-6-14(10-16)9-12(5-8-19-14)15-20(17,18)13-3-4-13/h11-13,15H,3-10H2,1-2H3/t12-,14-/m1/s1
InChIKeyFDPAPRAWXKAWQM-TZMCWYRMSA-N
MW302.44 g/mol
LogP1.10
Rot. Bonds4

About N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide

N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide (PubChem CID 97420147) has the molecular formula C14H26N2O3S and a molecular weight of 302.44 g/mol. Its IUPAC name is N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide.

Molecular Properties

Compound NameN-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide
PubChem CID97420147
Molecular FormulaC14H26N2O3S
Molecular Weight302.44 g/mol
Exact Mass302.17
IUPAC NameN-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide
SMILESCC(C)N1CC[C@@]2(C[C@H](NS(=O)(=O)C3CC3)CCO2)C1
InChIInChI=1S/C14H26N2O3S/c1-11(2)16-7-6-14(10-16)9-12(5-8-19-14)15-20(17,18)13-3-4-13/h11-13,15H,3-10H2,1-2H3/t12-,14-/m1/s1
InChIKeyFDPAPRAWXKAWQM-TZMCWYRMSA-N
XLogP1.10
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide?
The IUPAC name of N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide (CID 97420147) is N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide.
What is the SMILES notation for N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide?
The canonical SMILES for N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide is CC(C)N1CC[C@@]2(C[C@H](NS(=O)(=O)C3CC3)CCO2)C1.
What is the InChIKey of N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide?
The InChIKey is FDPAPRAWXKAWQM-TZMCWYRMSA-N. The full InChI is InChI=1S/C14H26N2O3S/c1-11(2)16-7-6-14(10-16)9-12(5-8-19-14)15-20(17,18)13-3-4-13/h11-13,15H,3-10H2,1-2H3/t12-,14-/m1/s1.
What are the key properties of N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide?
N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide has a molecular weight of 302.44 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5R,9R)-2-propan-2-yl-6-oxa-2-azaspiro[4.5]decan-9-yl]cyclopropanesulfonamide is sourced from PubChem (CID 97420147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).