(8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane

C14H26N2O — CID 122651493

IUPAC(8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane
SMILESCOC[C@@H]1C[C@@H]2CN(CC3CC3)CCCCN12
InChIInChI=1S/C14H26N2O/c1-17-11-14-8-13-10-15(9-12-4-5-12)6-2-3-7-16(13)14/h12-14H,2-11H2,1H3/t13-,14+/m1/s1
InChIKeyINSFSILSBORZEN-KGLIPLIRSA-N
MW238.37 g/mol
LogP1.58
Rot. Bonds4

About (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane

(8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane (PubChem CID 122651493) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane.

Molecular Properties

Compound Name(8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane
PubChem CID122651493
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name(8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane
SMILESCOC[C@@H]1C[C@@H]2CN(CC3CC3)CCCCN12
InChIInChI=1S/C14H26N2O/c1-17-11-14-8-13-10-15(9-12-4-5-12)6-2-3-7-16(13)14/h12-14H,2-11H2,1H3/t13-,14+/m1/s1
InChIKeyINSFSILSBORZEN-KGLIPLIRSA-N
XLogP1.58
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane?
The IUPAC name of (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane (CID 122651493) is (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane.
What is the SMILES notation for (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane?
The canonical SMILES for (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane is COC[C@@H]1C[C@@H]2CN(CC3CC3)CCCCN12.
What is the InChIKey of (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane?
The InChIKey is INSFSILSBORZEN-KGLIPLIRSA-N. The full InChI is InChI=1S/C14H26N2O/c1-17-11-14-8-13-10-15(9-12-4-5-12)6-2-3-7-16(13)14/h12-14H,2-11H2,1H3/t13-,14+/m1/s1.
What are the key properties of (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane?
(8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane has a molecular weight of 238.37 g/mol, XLogP of 1.58, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8R,10S)-6-(cyclopropylmethyl)-10-(methoxymethyl)-1,6-diazabicyclo[6.2.0]decane is sourced from PubChem (CID 122651493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).