7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine

C15H20N4O — CID 22649254

IUPAC7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine
SMILESNc1ncnc2cc(OCCCN3CCCC3)ccc12
InChIInChI=1S/C15H20N4O/c16-15-13-5-4-12(10-14(13)17-11-18-15)20-9-3-8-19-6-1-2-7-19/h4-5,10-11H,1-3,6-9H2,(H2,16,17,18)
InChIKeyVUCYAYFGAQYYNU-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.08
Rot. Bonds5

About 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine

7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine (PubChem CID 22649254) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine.

Molecular Properties

Compound Name7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine
PubChem CID22649254
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine
SMILESNc1ncnc2cc(OCCCN3CCCC3)ccc12
InChIInChI=1S/C15H20N4O/c16-15-13-5-4-12(10-14(13)17-11-18-15)20-9-3-8-19-6-1-2-7-19/h4-5,10-11H,1-3,6-9H2,(H2,16,17,18)
InChIKeyVUCYAYFGAQYYNU-UHFFFAOYSA-N
XLogP2.08
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

7-(3-piperazin-1-ylpropoxy)quinazolin-4-amine
CID 141103822
1-[4-[3-(4-aminoquinazolin-7-yl)oxypropyl]piperazin-1-yl]ethanone
CID 141289176
7-(4-pyrrolidin-1-ylbut-2-enoxy)quinazolin-4-amine
CID 69041177
6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-amine
CID 22649262
4-(3-pyrrolidin-1-ylpropoxy)pyridin-2-amine
CID 155587886
2-methyl-4-(3-piperidin-1-ylpropoxy)aniline
CID 39351364
3,6-bis(4-piperidin-1-ylbutoxy)acridine
CID 20553482
7-(4-morpholin-4-ylbut-2-enoxy)quinazolin-4-amine
CID 69039069
1-[3-[7-[3-(azetidin-1-yl)propoxy]dibenzofuran-2-yl]oxypropyl]azetidine
CID 57439391
1-[3-[7-(3-pyrrolidin-1-ylpropoxy)dibenzothiophen-2-yl]oxypropyl]pyrrolidine
CID 67163765
1-benzyl-3-[4-[[7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-yl]amino]phenyl]urea
CID 50898684
5-[4-(3-piperidin-1-ylpropoxy)phenyl]pyrimidine-2,4-diamine
CID 22326855

Frequently Asked Questions

What is the IUPAC name of 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine?
The IUPAC name of 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine (CID 22649254) is 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine.
What is the SMILES notation for 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine?
The canonical SMILES for 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine is Nc1ncnc2cc(OCCCN3CCCC3)ccc12.
What is the InChIKey of 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine?
The InChIKey is VUCYAYFGAQYYNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c16-15-13-5-4-12(10-14(13)17-11-18-15)20-9-3-8-19-6-1-2-7-19/h4-5,10-11H,1-3,6-9H2,(H2,16,17,18).
What are the key properties of 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine?
7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine has a molecular weight of 272.35 g/mol, XLogP of 2.08, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine is sourced from PubChem (CID 22649254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).