[2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine

C80H88F2N26O11 — CID 160958015

About [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine

[2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine (PubChem CID 160958015) has the molecular formula C80H88F2N26O11 and a molecular weight of 1627.75 g/mol. Its IUPAC name is [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine.

Molecular Properties

• Compound Name: [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine
• PubChem CID: 160958015
• Molecular Formula: C80H88F2N26O11
• Molecular Weight: 1627.75 g/mol
• Exact Mass: 1626.71
• IUPAC Name: [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine
• SMILES: COCCOc1ccc(F)c2nc(N)nc(NCc3cc(C)on3)c12.COCCOc1cccc2nc(N)nc(NCc3cc(C)on3)c12.COc1ccc(F)c2nc(N)nc(NCc3cc(C)on3)c12.C[C@@H](Nc1nc(N)nc2cc(C(=O)N3CCCC3)ccc12)c1ccccn1.Cc1cc(CNc2nc(N)nc3cccc(CO)c23)no1
• InChI: InChI=1S/C20H22N6O.C16H18FN5O3.C16H19N5O3.C14H14FN5O2.C14H15N5O2/c1-13(16-6-2-3-9-22-16)23-18-15-8-7-14(12-17(15)24-20(21)25-18)19(27)26-10-4-5-11-26;1-9-7-10(22-25-9)8-19-15-13-12(24-6-5-23-2)4-3-11(17)14(13)20-16(18)21-15;1-10-8-11(21-24-10)9-18-15-14-12(19-16(17)20-15)4-3-5-13(14)23-7-6-22-2;1-7-5-8(20-22-7)6-17-13-11-10(21-2)4-3-9(15)12(11)18-14(16)19-13;1-8-5-10(19-21-8)6-16-13-12-9(7-20)3-2-4-11(12)17-14(15)18-13/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H3,21,23,24,25);3-4,7H,5-6,8H2,1-2H3,(H3,18,19,20,21);3-5,8H,6-7,9H2,1-2H3,(H3,17,18,19,20);3-5H,6H2,1-2H3,(H3,16,17,18,19);2-5,20H,6-7H2,1H3,(H3,15,16,17,18)/t13-;;;;/m1..../s1
• InChIKey: SWQNITHUDHCNFZ-SVZPRBGCSA-N
• XLogP: 11.33
• TPSA: 522.85 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 36
• Rotatable Bonds: 26
• Heavy Atoms: 119
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1627.75
LogP ≤ 5	11.33
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine?

The IUPAC name of [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine (CID 160958015) is [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine.

What is the SMILES notation for [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine?

The canonical SMILES for [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine is COCCOc1ccc(F)c2nc(N)nc(NCc3cc(C)on3)c12.COCCOc1cccc2nc(N)nc(NCc3cc(C)on3)c12.COc1ccc(F)c2nc(N)nc(NCc3cc(C)on3)c12.C[C@@H](Nc1nc(N)nc2cc(C(=O)N3CCCC3)ccc12)c1ccccn1.Cc1cc(CNc2nc(N)nc3cccc(CO)c23)no1.

What is the InChIKey of [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine?

The InChIKey is SWQNITHUDHCNFZ-SVZPRBGCSA-N. The full InChI is InChI=1S/C20H22N6O.C16H18FN5O3.C16H19N5O3.C14H14FN5O2.C14H15N5O2/c1-13(16-6-2-3-9-22-16)23-18-15-8-7-14(12-17(15)24-20(21)25-18)19(27)26-10-4-5-11-26;1-9-7-10(22-25-9)8-19-15-13-12(24-6-5-23-2)4-3-11(17)14(13)20-16(18)21-15;1-10-8-11(21-24-10)9-18-15-14-12(19-16(17)20-15)4-3-5-13(14)23-7-6-22-2;1-7-5-8(20-22-7)6-17-13-11-10(21-2)4-3-9(15)12(11)18-14(16)19-13;1-8-5-10(19-21-8)6-16-13-12-9(7-20)3-2-4-11(12)17-14(15)18-13/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H3,21,23,24,25);3-4,7H,5-6,8H2,1-2H3,(H3,18,19,20,21);3-5,8H,6-7,9H2,1-2H3,(H3,17,18,19,20);3-5H,6H2,1-2H3,(H3,16,17,18,19);2-5,20H,6-7H2,1H3,(H3,15,16,17,18)/t13-;;;;/m1..../s1.

What are the key properties of [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine?

[2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine has a molecular weight of 1627.75 g/mol, XLogP of 11.33, 26 rotatable bonds, 11 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for [2-amino-4-[(5-methyl-1,2-oxazol-3-yl)methylamino]quinazolin-5-yl]methanol;[2-amino-4-[[(1R)-1-pyridin-2-ylethyl]amino]quinazolin-7-yl]-pyrrolidin-1-ylmethanone;8-fluoro-5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;8-fluoro-5-methoxy-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine;5-(2-methoxyethoxy)-4-N-[(5-methyl-1,2-oxazol-3-yl)methyl]quinazoline-2,4-diamine is sourced from PubChem (CID 160958015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).