6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine

C11H17N3 — CID 63549265

IUPAC6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine
SMILESCCCC1CCc2nc(N)ncc2C1
InChIInChI=1S/C11H17N3/c1-2-3-8-4-5-10-9(6-8)7-13-11(12)14-10/h7-8H,2-6H2,1H3,(H2,12,13,14)
InChIKeyHPWVTYMFZZIJJB-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.96
Rot. Bonds2

About 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine

6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine (PubChem CID 63549265) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine.

Molecular Properties

Compound Name6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine
PubChem CID63549265
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine
SMILESCCCC1CCc2nc(N)ncc2C1
InChIInChI=1S/C11H17N3/c1-2-3-8-4-5-10-9(6-8)7-13-11(12)14-10/h7-8H,2-6H2,1H3,(H2,12,13,14)
InChIKeyHPWVTYMFZZIJJB-UHFFFAOYSA-N
XLogP1.96
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine?
The IUPAC name of 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine (CID 63549265) is 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine.
What is the SMILES notation for 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine?
The canonical SMILES for 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine is CCCC1CCc2nc(N)ncc2C1.
What is the InChIKey of 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine?
The InChIKey is HPWVTYMFZZIJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-2-3-8-4-5-10-9(6-8)7-13-11(12)14-10/h7-8H,2-6H2,1H3,(H2,12,13,14).
What are the key properties of 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine?
6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine has a molecular weight of 191.28 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propyl-5,6,7,8-tetrahydroquinazolin-2-amine is sourced from PubChem (CID 63549265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).