ethane;1,2,6,7-tetrahydroquinazoline

C10H16N2 — CID 143195739

IUPACethane;1,2,6,7-tetrahydroquinazoline
SMILESC1=NCNC2=CCCC=C12.CC
InChIInChI=1S/C8H10N2.C2H6/c1-2-4-8-7(3-1)5-9-6-10-8;1-2/h3-5,10H,1-2,6H2;1-2H3
InChIKeyJUBZEBODHHREFS-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.25
Rot. Bonds

About ethane;1,2,6,7-tetrahydroquinazoline

ethane;1,2,6,7-tetrahydroquinazoline (PubChem CID 143195739) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is ethane;1,2,6,7-tetrahydroquinazoline.

Molecular Properties

Compound Nameethane;1,2,6,7-tetrahydroquinazoline
PubChem CID143195739
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Nameethane;1,2,6,7-tetrahydroquinazoline
SMILESC1=NCNC2=CCCC=C12.CC
InChIInChI=1S/C8H10N2.C2H6/c1-2-4-8-7(3-1)5-9-6-10-8;1-2/h3-5,10H,1-2,6H2;1-2H3
InChIKeyJUBZEBODHHREFS-UHFFFAOYSA-N
XLogP2.25
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;1,2,6,7-tetrahydroquinazoline?
The IUPAC name of ethane;1,2,6,7-tetrahydroquinazoline (CID 143195739) is ethane;1,2,6,7-tetrahydroquinazoline.
What is the SMILES notation for ethane;1,2,6,7-tetrahydroquinazoline?
The canonical SMILES for ethane;1,2,6,7-tetrahydroquinazoline is C1=NCNC2=CCCC=C12.CC.
What is the InChIKey of ethane;1,2,6,7-tetrahydroquinazoline?
The InChIKey is JUBZEBODHHREFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2.C2H6/c1-2-4-8-7(3-1)5-9-6-10-8;1-2/h3-5,10H,1-2,6H2;1-2H3.
What are the key properties of ethane;1,2,6,7-tetrahydroquinazoline?
ethane;1,2,6,7-tetrahydroquinazoline has a molecular weight of 164.25 g/mol, XLogP of 2.25, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1,2,6,7-tetrahydroquinazoline is sourced from PubChem (CID 143195739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).