N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide

C14H17N3O2 — CID 162656758

IUPACN-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1ncnc2ccc(OC)cc12
InChIInChI=1S/C14H17N3O2/c1-3-14(18)15-7-6-13-11-8-10(19-2)4-5-12(11)16-9-17-13/h4-5,8-9H,3,6-7H2,1-2H3,(H,15,18)
InChIKeyJFLBHRXUVVLSSD-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.71
Rot. Bonds5

About N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide

N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide (PubChem CID 162656758) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide
PubChem CID162656758
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1ncnc2ccc(OC)cc12
InChIInChI=1S/C14H17N3O2/c1-3-14(18)15-7-6-13-11-8-10(19-2)4-5-12(11)16-9-17-13/h4-5,8-9H,3,6-7H2,1-2H3,(H,15,18)
InChIKeyJFLBHRXUVVLSSD-UHFFFAOYSA-N
XLogP1.71
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(5-methoxy-2H-indazol-3-yl)ethyl]propanamide
CID 57230790
2-(6-methoxyquinazolin-4-yl)ethanamine
CID 105455353
2-[(6-methoxyquinazolin-4-yl)amino]ethanol
CID 21002851
4-[5-methoxy-3-[2-(propanoylamino)ethyl]indol-1-yl]-4-oxobutanoic acid
CID 155529430
N-[2-(6-methoxyquinolin-4-yl)ethyl]cyclopropanecarboxamide
CID 19709964
N-[[6-(4-methoxyphenyl)pyrimidin-4-yl]methyl]propanamide
CID 122262240
2-(7-methoxyquinazolin-4-yl)acetic acid
CID 105471989
methyl 3-(6-methoxyquinazolin-4-yl)sulfanylpropanoate
CID 21002930
N-[2-[5-methoxy-1-(2-phenylethyl)indol-3-yl]ethyl]propanamide
CID 10926166
N-[2-(4-methoxyanilino)ethyl]propanamide
CID 12709131
N-[2-(7-methoxy-3-methylisoquinolin-1-yl)ethyl]acetamide
CID 162686325
methyl 3-(6-methoxyquinolin-4-yl)-3-oxopropanoate
CID 82665606

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide?
The IUPAC name of N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide (CID 162656758) is N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide.
What is the SMILES notation for N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide?
The canonical SMILES for N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide is CCC(=O)NCCc1ncnc2ccc(OC)cc12.
What is the InChIKey of N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide?
The InChIKey is JFLBHRXUVVLSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-14(18)15-7-6-13-11-8-10(19-2)4-5-12(11)16-9-17-13/h4-5,8-9H,3,6-7H2,1-2H3,(H,15,18).
What are the key properties of N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide?
N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide has a molecular weight of 259.31 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methoxyquinazolin-4-yl)ethyl]propanamide is sourced from PubChem (CID 162656758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).