2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one

C15H20N4O2 — CID 137308278

IUPAC2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one
SMILESCc1nc2ccc(NCCN3CCOCC3)cc2c(=O)[nH]1
InChIInChI=1S/C15H20N4O2/c1-11-17-14-3-2-12(10-13(14)15(20)18-11)16-4-5-19-6-8-21-9-7-19/h2-3,10,16H,4-9H2,1H3,(H,17,18,20)
InChIKeyBHLMMBFWZHPIDT-UHFFFAOYSA-N
MW288.35 g/mol
LogP0.98
Rot. Bonds4

About 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one

2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one (PubChem CID 137308278) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one.

Molecular Properties

Compound Name2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one
PubChem CID137308278
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one
SMILESCc1nc2ccc(NCCN3CCOCC3)cc2c(=O)[nH]1
InChIInChI=1S/C15H20N4O2/c1-11-17-14-3-2-12(10-13(14)15(20)18-11)16-4-5-19-6-8-21-9-7-19/h2-3,10,16H,4-9H2,1H3,(H,17,18,20)
InChIKeyBHLMMBFWZHPIDT-UHFFFAOYSA-N
XLogP0.98
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one
CID 136779605
2-ethyl-N-(2-morpholin-4-ylethyl)-3H-benzimidazol-5-amine
CID 96680191
2-methyl-6-[(4-methylphenyl)methylamino]-3H-quinazolin-4-one
CID 137101004
2-methyl-4-(2-morpholin-4-ylethylamino)benzoic acid
CID 81282507
3-chloro-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 28568493
3-fluoro-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 28583324
3-bromo-4-methyl-N-(2-morpholin-4-ylethyl)aniline
CID 39420305
14-(methylsulfanylamino)-5-(2-morpholin-4-ylethylamino)-7-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-one
CID 143383530
N-(2-morpholin-4-ylethyl)-1H-indol-5-amine
CID 82539146
N-(2-morpholin-4-ylethyl)-2-(6-nitro-1H-indazol-3-yl)-3H-benzimidazol-5-amine
CID 135820230
N-(2-morpholin-4-ylethyl)-1H-indol-6-amine
CID 69376753
6-amino-2-(2-morpholin-4-ylethylamino)-1,7-dihydroimidazo[4,5-g]quinazolin-8-one
CID 135566918

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one?
The IUPAC name of 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one (CID 137308278) is 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one.
What is the SMILES notation for 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one?
The canonical SMILES for 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one is Cc1nc2ccc(NCCN3CCOCC3)cc2c(=O)[nH]1.
What is the InChIKey of 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one?
The InChIKey is BHLMMBFWZHPIDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-11-17-14-3-2-12(10-13(14)15(20)18-11)16-4-5-19-6-8-21-9-7-19/h2-3,10,16H,4-9H2,1H3,(H,17,18,20).
What are the key properties of 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one?
2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one has a molecular weight of 288.35 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-morpholin-4-ylethylamino)-3H-quinazolin-4-one is sourced from PubChem (CID 137308278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).