6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine

C20H17N3O2 — CID 3234739

IUPAC6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine
SMILESCOc1ccccc1CNc1ncnc2ccc(-c3ccoc3)cc12
InChIInChI=1S/C20H17N3O2/c1-24-19-5-3-2-4-15(19)11-21-20-17-10-14(16-8-9-25-12-16)6-7-18(17)22-13-23-20/h2-10,12-13H,11H2,1H3,(H,21,22,23)
InChIKeyADDQUXPFJFWRFB-UHFFFAOYSA-N
MW331.38 g/mol
LogP4.51
Rot. Bonds5

About 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine

6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine (PubChem CID 3234739) has the molecular formula C20H17N3O2 and a molecular weight of 331.38 g/mol. Its IUPAC name is 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine.

Molecular Properties

Compound Name6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine
PubChem CID3234739
Molecular FormulaC20H17N3O2
Molecular Weight331.38 g/mol
Exact Mass331.13
IUPAC Name6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine
SMILESCOc1ccccc1CNc1ncnc2ccc(-c3ccoc3)cc12
InChIInChI=1S/C20H17N3O2/c1-24-19-5-3-2-4-15(19)11-21-20-17-10-14(16-8-9-25-12-16)6-7-18(17)22-13-23-20/h2-10,12-13H,11H2,1H3,(H,21,22,23)
InChIKeyADDQUXPFJFWRFB-UHFFFAOYSA-N
XLogP4.51
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.38
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2-methoxy-4-methylphenyl)methyl]quinazolin-4-amine
CID 91644459
N-[(2-methoxyphenyl)methyl]-6-phenylthieno[3,2-d]pyrimidin-4-amine
CID 25164407
6-(2-methoxyphenyl)-N-[(5-methylpyrazin-2-yl)methyl]quinazolin-4-amine
CID 3234919
6-bromo-N-[(2,4-dimethoxyphenyl)methyl]quinazolin-4-amine
CID 67085882
6-(2-methoxyphenyl)-N-(2-morpholin-4-ylethyl)quinazolin-4-amine
CID 3232787
N-benzyl-6-[4-(dimethylamino)phenyl]quinazolin-4-amine
CID 3233864
6-(2-methoxyphenyl)-N-phenylquinazolin-4-amine
CID 3235342
N-cyclopropyl-6-[3-[(cyclopropylamino)methyl]-4-methoxyphenyl]quinazolin-4-amine
CID 68943884
6-(3-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]-2-pyridin-3-ylquinazolin-4-amine
CID 71180587
N-cyclopropyl-N-[[3-[4-[(2,4-dimethoxyphenyl)methylamino]quinazolin-6-yl]phenyl]methyl]benzamide
CID 57434863
N-[(3,4-dimethoxyphenyl)methyl]quinazolin-4-amine
CID 21002356
6-chloro-N-[(2-chlorophenyl)methyl]quinazolin-4-amine
CID 46879729

Frequently Asked Questions

What is the IUPAC name of 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine?
The IUPAC name of 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine (CID 3234739) is 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine.
What is the SMILES notation for 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine?
The canonical SMILES for 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine is COc1ccccc1CNc1ncnc2ccc(-c3ccoc3)cc12.
What is the InChIKey of 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine?
The InChIKey is ADDQUXPFJFWRFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O2/c1-24-19-5-3-2-4-15(19)11-21-20-17-10-14(16-8-9-25-12-16)6-7-18(17)22-13-23-20/h2-10,12-13H,11H2,1H3,(H,21,22,23).
What are the key properties of 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine?
6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine has a molecular weight of 331.38 g/mol, XLogP of 4.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(furan-3-yl)-N-[(2-methoxyphenyl)methyl]quinazolin-4-amine is sourced from PubChem (CID 3234739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).