2-pyrrolidin-3-yloxyquinazoline

C12H13N3O — CID 114789720

IUPAC2-pyrrolidin-3-yloxyquinazoline
SMILESc1ccc2nc(OC3CCNC3)ncc2c1
InChIInChI=1S/C12H13N3O/c1-2-4-11-9(3-1)7-14-12(15-11)16-10-5-6-13-8-10/h1-4,7,10,13H,5-6,8H2
InChIKeyBHGSCIYDVCXBMV-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.37
Rot. Bonds2

About 2-pyrrolidin-3-yloxyquinazoline

2-pyrrolidin-3-yloxyquinazoline (PubChem CID 114789720) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 2-pyrrolidin-3-yloxyquinazoline.

Molecular Properties

Compound Name2-pyrrolidin-3-yloxyquinazoline
PubChem CID114789720
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name2-pyrrolidin-3-yloxyquinazoline
SMILESc1ccc2nc(OC3CCNC3)ncc2c1
InChIInChI=1S/C12H13N3O/c1-2-4-11-9(3-1)7-14-12(15-11)16-10-5-6-13-8-10/h1-4,7,10,13H,5-6,8H2
InChIKeyBHGSCIYDVCXBMV-UHFFFAOYSA-N
XLogP1.37
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-pyrrolidin-3-yloxyquinazoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(oxolan-3-yloxy)quinazoline
CID 67362717
5-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyrimidine
CID 95031425
5-fluoro-2-[(3S)-pyrrolidin-3-yl]oxypyrimidine
CID 71643584
4-methyl-2-pyrrolidin-3-yloxypyrimidine;hydrochloride
CID 71639242
2-piperidin-3-yloxyquinoline
CID 62348175
1-pyrrolidin-3-yloxyisoquinoline;hydrochloride
CID 14497379
2-[(3R)-pyrrolidin-3-yl]oxypyridine;hydrochloride
CID 71302121
3-(azetidin-3-yloxy)-1,2,4-benzotriazine
CID 103204985
2-methoxyquinazoline
CID 594801
N-ethyl-2-pyrrolidin-3-yloxypyrimidin-4-amine
CID 129317548
3-(benzenesulfonyl)-6-pyrrolidin-3-yloxyquinoline
CID 69129167
4-chloro-5-methyl-2-[(3S)-piperidin-3-yl]oxypyrimidine
CID 71639114

Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-3-yloxyquinazoline?
The IUPAC name of 2-pyrrolidin-3-yloxyquinazoline (CID 114789720) is 2-pyrrolidin-3-yloxyquinazoline.
What is the SMILES notation for 2-pyrrolidin-3-yloxyquinazoline?
The canonical SMILES for 2-pyrrolidin-3-yloxyquinazoline is c1ccc2nc(OC3CCNC3)ncc2c1.
What is the InChIKey of 2-pyrrolidin-3-yloxyquinazoline?
The InChIKey is BHGSCIYDVCXBMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c1-2-4-11-9(3-1)7-14-12(15-11)16-10-5-6-13-8-10/h1-4,7,10,13H,5-6,8H2.
What are the key properties of 2-pyrrolidin-3-yloxyquinazoline?
2-pyrrolidin-3-yloxyquinazoline has a molecular weight of 215.26 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-3-yloxyquinazoline is sourced from PubChem (CID 114789720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).