2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine

C19H22N4O — CID 83277016

IUPAC2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine
SMILESCc1ccc2nc(-c3ccco3)nc(NCCN3CCCC3)c2c1
InChIInChI=1S/C19H22N4O/c1-14-6-7-16-15(13-14)18(20-8-11-23-9-2-3-10-23)22-19(21-16)17-5-4-12-24-17/h4-7,12-13H,2-3,8-11H2,1H3,(H,20,21,22)
InChIKeyKWOUAXWQYDNHJV-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.71
Rot. Bonds5

About 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine

2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine (PubChem CID 83277016) has the molecular formula C19H22N4O and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine.

Molecular Properties

Compound Name2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine
PubChem CID83277016
Molecular FormulaC19H22N4O
Molecular Weight322.41 g/mol
Exact Mass322.18
IUPAC Name2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine
SMILESCc1ccc2nc(-c3ccco3)nc(NCCN3CCCC3)c2c1
InChIInChI=1S/C19H22N4O/c1-14-6-7-16-15(13-14)18(20-8-11-23-9-2-3-10-23)22-19(21-16)17-5-4-12-24-17/h4-7,12-13H,2-3,8-11H2,1H3,(H,20,21,22)
InChIKeyKWOUAXWQYDNHJV-UHFFFAOYSA-N
XLogP3.71
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine?
The IUPAC name of 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine (CID 83277016) is 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine.
What is the SMILES notation for 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine?
The canonical SMILES for 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine is Cc1ccc2nc(-c3ccco3)nc(NCCN3CCCC3)c2c1.
What is the InChIKey of 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine?
The InChIKey is KWOUAXWQYDNHJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O/c1-14-6-7-16-15(13-14)18(20-8-11-23-9-2-3-10-23)22-19(21-16)17-5-4-12-24-17/h4-7,12-13H,2-3,8-11H2,1H3,(H,20,21,22).
What are the key properties of 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine?
2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine has a molecular weight of 322.41 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinazolin-4-amine is sourced from PubChem (CID 83277016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).