N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide

C23H30N4O2 — CID 25298905

IUPACN-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1CC(=O)N[C@H]1CC(C)(C)Cc2nc(N3CCOCC3)ncc21
InChIInChI=1S/C23H30N4O2/c1-16-6-4-5-7-17(16)12-21(28)25-19-13-23(2,3)14-20-18(19)15-24-22(26-20)27-8-10-29-11-9-27/h4-7,15,19H,8-14H2,1-3H3,(H,25,28)/t19-/m0/s1
InChIKeyIFAUBOHJJNMAOW-IBGZPJMESA-N
MW394.52 g/mol
LogP2.99
Rot. Bonds4

About N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide

N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide (PubChem CID 25298905) has the molecular formula C23H30N4O2 and a molecular weight of 394.52 g/mol. Its IUPAC name is N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide
PubChem CID25298905
Molecular FormulaC23H30N4O2
Molecular Weight394.52 g/mol
Exact Mass394.24
IUPAC NameN-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide
SMILESCc1ccccc1CC(=O)N[C@H]1CC(C)(C)Cc2nc(N3CCOCC3)ncc21
InChIInChI=1S/C23H30N4O2/c1-16-6-4-5-7-17(16)12-21(28)25-19-13-23(2,3)14-20-18(19)15-24-22(26-20)27-8-10-29-11-9-27/h4-7,15,19H,8-14H2,1-3H3,(H,25,28)/t19-/m0/s1
InChIKeyIFAUBOHJJNMAOW-IBGZPJMESA-N
XLogP2.99
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.52
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide with MolForge

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Related Compounds

N-[2-(2,6-dimethylmorpholin-4-yl)-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide
CID 110237861
N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-6-methylpyridine-3-carboxamide
CID 25384827
N-(7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl)cyclohexanecarboxamide
CID 45221847
N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-1H-indole-2-carboxamide
CID 97117496
N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2,5-dimethylfuran-3-carboxamide
CID 25461451
N-[(5R)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-1H-pyrazole-4-carboxamide
CID 42302158
N-[(5R)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-1,5-dimethylpyrazole-3-carboxamide
CID 26390488
N-(7,7-dimethyl-2-pyrrolidin-1-yl-6,8-dihydro-5H-quinazolin-5-yl)oxane-4-carboxamide
CID 110237920
2-[(7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl)amino]-N-methylpyridine-3-carboxamide
CID 72905311
N-(7,7-dimethyl-2-pyrrolidin-1-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-(3-methoxyphenyl)acetamide
CID 110237895
4-N-(7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 72935142
N-[2-(4-hydroxypiperidin-1-yl)-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-3-methylfuran-2-carboxamide
CID 45241281

Frequently Asked Questions

What is the IUPAC name of N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide?
The IUPAC name of N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide (CID 25298905) is N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide is Cc1ccccc1CC(=O)N[C@H]1CC(C)(C)Cc2nc(N3CCOCC3)ncc21.
What is the InChIKey of N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide?
The InChIKey is IFAUBOHJJNMAOW-IBGZPJMESA-N. The full InChI is InChI=1S/C23H30N4O2/c1-16-6-4-5-7-17(16)12-21(28)25-19-13-23(2,3)14-20-18(19)15-24-22(26-20)27-8-10-29-11-9-27/h4-7,15,19H,8-14H2,1-3H3,(H,25,28)/t19-/m0/s1.
What are the key properties of N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide?
N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide has a molecular weight of 394.52 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5S)-7,7-dimethyl-2-morpholin-4-yl-6,8-dihydro-5H-quinazolin-5-yl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 25298905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).