2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine

C15H25N3O — CID 116728315

IUPAC2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESCNC1CCCc2nc(C(OC)C(C)(C)C)ncc21
InChIInChI=1S/C15H25N3O/c1-15(2,3)13(19-5)14-17-9-10-11(16-4)7-6-8-12(10)18-14/h9,11,13,16H,6-8H2,1-5H3
InChIKeyFCLGQNPQPBSAEP-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.81
Rot. Bonds3

About 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine

2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine (PubChem CID 116728315) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine.

Molecular Properties

Compound Name2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine
PubChem CID116728315
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine
SMILESCNC1CCCc2nc(C(OC)C(C)(C)C)ncc21
InChIInChI=1S/C15H25N3O/c1-15(2,3)13(19-5)14-17-9-10-11(16-4)7-6-8-12(10)18-14/h9,11,13,16H,6-8H2,1-5H3
InChIKeyFCLGQNPQPBSAEP-UHFFFAOYSA-N
XLogP2.81
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine 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 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine?
The IUPAC name of 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine (CID 116728315) is 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine.
What is the SMILES notation for 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine?
The canonical SMILES for 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine is CNC1CCCc2nc(C(OC)C(C)(C)C)ncc21.
What is the InChIKey of 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine?
The InChIKey is FCLGQNPQPBSAEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-15(2,3)13(19-5)14-17-9-10-11(16-4)7-6-8-12(10)18-14/h9,11,13,16H,6-8H2,1-5H3.
What are the key properties of 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine?
2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine has a molecular weight of 263.38 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxy-2,2-dimethylpropyl)-N-methyl-5,6,7,8-tetrahydroquinazolin-5-amine is sourced from PubChem (CID 116728315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).