3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine

C20H23N3 — CID 86297843

IUPAC3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine
SMILESCCCc1ccc2c(c1)N=C(N)N(C1Cc3ccccc3C1)C2
InChIInChI=1S/C20H23N3/c1-2-5-14-8-9-17-13-23(20(21)22-19(17)10-14)18-11-15-6-3-4-7-16(15)12-18/h3-4,6-10,18H,2,5,11-13H2,1H3,(H2,21,22)
InChIKeyKSFHUAODFIJYMN-UHFFFAOYSA-N
MW305.43 g/mol
LogP3.57
Rot. Bonds3

About 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine

3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine (PubChem CID 86297843) has the molecular formula C20H23N3 and a molecular weight of 305.43 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine
PubChem CID86297843
Molecular FormulaC20H23N3
Molecular Weight305.43 g/mol
Exact Mass305.19
IUPAC Name3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine
SMILESCCCc1ccc2c(c1)N=C(N)N(C1Cc3ccccc3C1)C2
InChIInChI=1S/C20H23N3/c1-2-5-14-8-9-17-13-23(20(21)22-19(17)10-14)18-11-15-6-3-4-7-16(15)12-18/h3-4,6-10,18H,2,5,11-13H2,1H3,(H2,21,22)
InChIKeyKSFHUAODFIJYMN-UHFFFAOYSA-N
XLogP3.57
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.43
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-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 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine?
The IUPAC name of 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine (CID 86297843) is 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine.
What is the SMILES notation for 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine?
The canonical SMILES for 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine is CCCc1ccc2c(c1)N=C(N)N(C1Cc3ccccc3C1)C2.
What is the InChIKey of 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine?
The InChIKey is KSFHUAODFIJYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3/c1-2-5-14-8-9-17-13-23(20(21)22-19(17)10-14)18-11-15-6-3-4-7-16(15)12-18/h3-4,6-10,18H,2,5,11-13H2,1H3,(H2,21,22).
What are the key properties of 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine?
3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine has a molecular weight of 305.43 g/mol, XLogP of 3.57, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-inden-2-yl)-7-propyl-4H-quinazolin-2-amine is sourced from PubChem (CID 86297843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).