8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine

C16H20N2O — CID 746044

IUPAC8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine
SMILESCN(C)c1ccc2c3c(ccc(N(C)C)c13)COC2
InChIInChI=1S/C16H20N2O/c1-17(2)13-7-5-11-9-19-10-12-6-8-14(18(3)4)16(13)15(11)12/h5-8H,9-10H2,1-4H3
InChIKeyDQIWRQIXCBPXNI-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.00
Rot. Bonds2

About 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine

8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine (PubChem CID 746044) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine.

Molecular Properties

Compound Name8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine
PubChem CID746044
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine
SMILESCN(C)c1ccc2c3c(ccc(N(C)C)c13)COC2
InChIInChI=1S/C16H20N2O/c1-17(2)13-7-5-11-9-19-10-12-6-8-14(18(3)4)16(13)15(11)12/h5-8H,9-10H2,1-4H3
InChIKeyDQIWRQIXCBPXNI-UHFFFAOYSA-N
XLogP3.00
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine?
The IUPAC name of 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine (CID 746044) is 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine.
What is the SMILES notation for 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine?
The canonical SMILES for 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine is CN(C)c1ccc2c3c(ccc(N(C)C)c13)COC2.
What is the InChIKey of 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine?
The InChIKey is DQIWRQIXCBPXNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-17(2)13-7-5-11-9-19-10-12-6-8-14(18(3)4)16(13)15(11)12/h5-8H,9-10H2,1-4H3.
What are the key properties of 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine?
8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine has a molecular weight of 256.35 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N,8-N,10-N,10-N-tetramethyl-3-oxatricyclo[7.3.1.05,13]trideca-1(13),5,7,9,11-pentaene-8,10-diamine is sourced from PubChem (CID 746044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).