8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine

C10H16N4 — CID 83878214

IUPAC8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine
SMILESNCCC1CCCc2cnc(N)nc21
InChIInChI=1S/C10H16N4/c11-5-4-7-2-1-3-8-6-13-10(12)14-9(7)8/h6-7H,1-5,11H2,(H2,12,13,14)
InChIKeyDZAPAWXYXYUBCI-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.83
Rot. Bonds2

About 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine

8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine (PubChem CID 83878214) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine.

Molecular Properties

Compound Name8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine
PubChem CID83878214
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine
SMILESNCCC1CCCc2cnc(N)nc21
InChIInChI=1S/C10H16N4/c11-5-4-7-2-1-3-8-6-13-10(12)14-9(7)8/h6-7H,1-5,11H2,(H2,12,13,14)
InChIKeyDZAPAWXYXYUBCI-UHFFFAOYSA-N
XLogP0.83
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine?
The IUPAC name of 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine (CID 83878214) is 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine.
What is the SMILES notation for 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine?
The canonical SMILES for 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine is NCCC1CCCc2cnc(N)nc21.
What is the InChIKey of 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine?
The InChIKey is DZAPAWXYXYUBCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c11-5-4-7-2-1-3-8-6-13-10(12)14-9(7)8/h6-7H,1-5,11H2,(H2,12,13,14).
What are the key properties of 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine?
8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine has a molecular weight of 192.27 g/mol, XLogP of 0.83, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-aminoethyl)-5,6,7,8-tetrahydroquinazolin-2-amine is sourced from PubChem (CID 83878214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).