2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide

C16H24N4O2 — CID 110237938

IUPAC2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide
SMILESCC(C)C(=O)NC1CCCc2nc(N3CCOCC3)ncc21
InChIInChI=1S/C16H24N4O2/c1-11(2)15(21)18-13-4-3-5-14-12(13)10-17-16(19-14)20-6-8-22-9-7-20/h10-11,13H,3-9H2,1-2H3,(H,18,21)
InChIKeyOEJKQSHGWWHUCP-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.46
Rot. Bonds3

About 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide

2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide (PubChem CID 110237938) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide
PubChem CID110237938
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide
SMILESCC(C)C(=O)NC1CCCc2nc(N3CCOCC3)ncc21
InChIInChI=1S/C16H24N4O2/c1-11(2)15(21)18-13-4-3-5-14-12(13)10-17-16(19-14)20-6-8-22-9-7-20/h10-11,13H,3-9H2,1-2H3,(H,18,21)
InChIKeyOEJKQSHGWWHUCP-UHFFFAOYSA-N
XLogP1.46
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide?
The IUPAC name of 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide (CID 110237938) is 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide?
The canonical SMILES for 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide is CC(C)C(=O)NC1CCCc2nc(N3CCOCC3)ncc21.
What is the InChIKey of 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide?
The InChIKey is OEJKQSHGWWHUCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-11(2)15(21)18-13-4-3-5-14-12(13)10-17-16(19-14)20-6-8-22-9-7-20/h10-11,13H,3-9H2,1-2H3,(H,18,21).
What are the key properties of 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide?
2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide has a molecular weight of 304.39 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-morpholin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide is sourced from PubChem (CID 110237938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).