2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine

C17H18N4OS — CID 91963594

IUPAC2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine
SMILESc1csc(CNc2nc(N3CCOCC3)nc3ccccc23)c1
InChIInChI=1S/C17H18N4OS/c1-2-6-15-14(5-1)16(18-12-13-4-3-11-23-13)20-17(19-15)21-7-9-22-10-8-21/h1-6,11H,7-10,12H2,(H,18,19,20)
InChIKeyBUBAAZIBFRIRPK-UHFFFAOYSA-N
MW326.43 g/mol
LogP3.14
Rot. Bonds4

About 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine

2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine (PubChem CID 91963594) has the molecular formula C17H18N4OS and a molecular weight of 326.43 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine
PubChem CID91963594
Molecular FormulaC17H18N4OS
Molecular Weight326.43 g/mol
Exact Mass326.12
IUPAC Name2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine
SMILESc1csc(CNc2nc(N3CCOCC3)nc3ccccc23)c1
InChIInChI=1S/C17H18N4OS/c1-2-6-15-14(5-1)16(18-12-13-4-3-11-23-13)20-17(19-15)21-7-9-22-10-8-21/h1-6,11H,7-10,12H2,(H,18,19,20)
InChIKeyBUBAAZIBFRIRPK-UHFFFAOYSA-N
XLogP3.14
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.43
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine 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-(4-pyrimidin-2-ylpiperazin-1-yl)-N-(thiophen-2-ylmethyl)quinazolin-4-amine
CID 91963616
2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(thiophen-2-ylmethyl)quinazolin-4-amine
CID 91963614
N-[(4-methoxyphenyl)methyl]-2-morpholin-4-ylquinazolin-4-amine
CID 68516298
N-(3-methoxypropyl)-2-morpholin-4-ylquinazolin-4-amine
CID 91963759
4-N-methyl-6-morpholin-4-yl-2-N-(thiophen-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80773229
2-morpholin-4-yl-N-(oxolan-2-ylmethyl)quinazolin-4-amine chloride
CID 53351083
2-N-ethyl-4-N-(thiophen-2-ylmethyl)quinazoline-2,4-diamine
CID 80776181
N-(thiophen-2-ylmethyl)quinazolin-4-amine
CID 4286982
4-N-prop-2-enyl-2-N-(thiophen-2-ylmethyl)quinazoline-2,4-diamine
CID 91963705
4-N-propyl-2-N-(thiophen-2-ylmethyl)quinazoline-2,4-diamine
CID 91966295
2-(3-methylpiperidin-1-yl)-N-(2-thiophen-2-ylethyl)quinazolin-4-amine
CID 91963859
N-(furan-2-ylmethyl)-2-(4-phenylpiperazin-1-yl)quinazolin-4-amine;hydron;chloride
CID 660740

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine?
The IUPAC name of 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine (CID 91963594) is 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine.
What is the SMILES notation for 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine?
The canonical SMILES for 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine is c1csc(CNc2nc(N3CCOCC3)nc3ccccc23)c1.
What is the InChIKey of 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine?
The InChIKey is BUBAAZIBFRIRPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4OS/c1-2-6-15-14(5-1)16(18-12-13-4-3-11-23-13)20-17(19-15)21-7-9-22-10-8-21/h1-6,11H,7-10,12H2,(H,18,19,20).
What are the key properties of 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine?
2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine has a molecular weight of 326.43 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(thiophen-2-ylmethyl)quinazolin-4-amine is sourced from PubChem (CID 91963594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).