N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide

C19H21N5O3 — CID 138587836

IUPACN-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide
SMILESCc1ncc(-c2ccc3cnc(NC(=O)CCN4CCOCC4)nc3c2)o1
InChIInChI=1S/C19H21N5O3/c1-13-20-12-17(27-13)14-2-3-15-11-21-19(22-16(15)10-14)23-18(25)4-5-24-6-8-26-9-7-24/h2-3,10-12H,4-9H2,1H3,(H,21,22,23,25)
InChIKeyPTFNYMLLQSEXOI-UHFFFAOYSA-N
MW367.41 g/mol
LogP2.25
Rot. Bonds5

About N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide

N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide (PubChem CID 138587836) has the molecular formula C19H21N5O3 and a molecular weight of 367.41 g/mol. Its IUPAC name is N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide
PubChem CID138587836
Molecular FormulaC19H21N5O3
Molecular Weight367.41 g/mol
Exact Mass367.16
IUPAC NameN-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide
SMILESCc1ncc(-c2ccc3cnc(NC(=O)CCN4CCOCC4)nc3c2)o1
InChIInChI=1S/C19H21N5O3/c1-13-20-12-17(27-13)14-2-3-15-11-21-19(22-16(15)10-14)23-18(25)4-5-24-6-8-26-9-7-24/h2-3,10-12H,4-9H2,1H3,(H,21,22,23,25)
InChIKeyPTFNYMLLQSEXOI-UHFFFAOYSA-N
XLogP2.25
TPSA93.38 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.41
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide?
The IUPAC name of N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide (CID 138587836) is N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide is Cc1ncc(-c2ccc3cnc(NC(=O)CCN4CCOCC4)nc3c2)o1.
What is the InChIKey of N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide?
The InChIKey is PTFNYMLLQSEXOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3/c1-13-20-12-17(27-13)14-2-3-15-11-21-19(22-16(15)10-14)23-18(25)4-5-24-6-8-26-9-7-24/h2-3,10-12H,4-9H2,1H3,(H,21,22,23,25).
What are the key properties of N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide?
N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide has a molecular weight of 367.41 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(2-methyl-1,3-oxazol-5-yl)quinazolin-2-yl]-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 138587836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).