4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide

C15H17N3O3 — CID 110332321

IUPAC4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide
SMILESCCCNC(=O)c1cc(-c2cccc(OC)c2)nc(=O)[nH]1
InChIInChI=1S/C15H17N3O3/c1-3-7-16-14(19)13-9-12(17-15(20)18-13)10-5-4-6-11(8-10)21-2/h4-6,8-9H,3,7H2,1-2H3,(H,16,19)(H,17,18,20)
InChIKeyAOXVRUCOWROQQZ-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.59
Rot. Bonds5

About 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide

4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide (PubChem CID 110332321) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide.

Molecular Properties

Compound Name4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide
PubChem CID110332321
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide
SMILESCCCNC(=O)c1cc(-c2cccc(OC)c2)nc(=O)[nH]1
InChIInChI=1S/C15H17N3O3/c1-3-7-16-14(19)13-9-12(17-15(20)18-13)10-5-4-6-11(8-10)21-2/h4-6,8-9H,3,7H2,1-2H3,(H,16,19)(H,17,18,20)
InChIKeyAOXVRUCOWROQQZ-UHFFFAOYSA-N
XLogP1.59
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-4-(4-methoxyphenyl)-2-oxo-1H-pyrimidine-6-carboxamide
CID 110295366
N-[3-(4-fluorophenoxy)propyl]-4-(4-methoxyphenyl)-2-oxo-1H-pyrimidine-6-carboxamide
CID 110307304
N-[3-(4-hydroxyphenyl)propyl]-4-(4-methoxyphenyl)-2-oxo-1H-pyrimidine-6-carboxamide
CID 110421281
3-(3-methoxyphenyl)-N-[2-(methylsulfamoyl)ethyl]-1H-pyrazole-5-carboxamide
CID 70776702
4-(3-methoxyphenyl)-6-(4-phenylpiperazine-1-carbonyl)-1H-pyrimidin-2-one
CID 110332367
4-(3-methoxyphenyl)-6-(3-methylpiperidine-1-carbonyl)-1H-pyrimidin-2-one
CID 110332379
N-(2-ethoxyphenyl)-4-(4-methoxyphenyl)-2-oxo-1H-pyrimidine-6-carboxamide
CID 110295452
N-[(4-fluorophenyl)methyl]-3-(3-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 19509626
3-(3-methoxyphenyl)-N-[2-(3-methyl-6-oxopyridazin-1-yl)ethyl]-1H-pyrazole-5-carboxamide
CID 121059097
5-(3-methoxyphenyl)-1-phenyl-N-propyl-1,2,4-triazole-3-carboxamide
CID 17052437
4-(4-methoxyphenyl)-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxo-1H-pyrimidine-6-carboxamide
CID 110426928
N-hexyl-2-(3-methoxyphenyl)quinoline-4-carboxamide
CID 4540547

Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide?
The IUPAC name of 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide (CID 110332321) is 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide.
What is the SMILES notation for 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide?
The canonical SMILES for 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide is CCCNC(=O)c1cc(-c2cccc(OC)c2)nc(=O)[nH]1.
What is the InChIKey of 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide?
The InChIKey is AOXVRUCOWROQQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-3-7-16-14(19)13-9-12(17-15(20)18-13)10-5-4-6-11(8-10)21-2/h4-6,8-9H,3,7H2,1-2H3,(H,16,19)(H,17,18,20).
What are the key properties of 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide?
4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxyphenyl)-2-oxo-N-propyl-1H-pyrimidine-6-carboxamide is sourced from PubChem (CID 110332321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).