N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide

C14H15N3O2 — CID 102922038

IUPACN-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide
SMILESCCN(C(=O)c1cncnc1)c1cc(O)ccc1C
InChIInChI=1S/C14H15N3O2/c1-3-17(13-6-12(18)5-4-10(13)2)14(19)11-7-15-9-16-8-11/h4-9,18H,3H2,1-2H3
InChIKeyJKIUEGWHVYVWIT-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.16
Rot. Bonds3

About N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide

N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide (PubChem CID 102922038) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide
PubChem CID102922038
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide
SMILESCCN(C(=O)c1cncnc1)c1cc(O)ccc1C
InChIInChI=1S/C14H15N3O2/c1-3-17(13-6-12(18)5-4-10(13)2)14(19)11-7-15-9-16-8-11/h4-9,18H,3H2,1-2H3
InChIKeyJKIUEGWHVYVWIT-UHFFFAOYSA-N
XLogP2.16
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridine-3-carboxamide
CID 107856541
N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-iodobenzamide
CID 28978793
4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
CID 107733330
3-chloro-N-ethyl-4-hydroxy-N-(5-hydroxy-2-methylphenyl)benzamide
CID 29273643
N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 28780674
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylfuran-3-carboxamide
CID 28740049
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-methylbenzamide
CID 107733112
2-bromo-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
CID 28739954
2-[[ethyl-(5-hydroxy-2-methylphenyl)carbamoyl]amino]acetic acid
CID 107737112
5-chloro-N-ethyl-2-fluoro-N-(5-hydroxy-2-methylphenyl)benzamide
CID 28516961
N-ethyl-N-(5-hydroxy-2-methylphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 104772781
2-amino-5-bromo-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
CID 107736855

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide?
The IUPAC name of N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide (CID 102922038) is N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide.
What is the SMILES notation for N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide?
The canonical SMILES for N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide is CCN(C(=O)c1cncnc1)c1cc(O)ccc1C.
What is the InChIKey of N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide?
The InChIKey is JKIUEGWHVYVWIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c1-3-17(13-6-12(18)5-4-10(13)2)14(19)11-7-15-9-16-8-11/h4-9,18H,3H2,1-2H3.
What are the key properties of N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide?
N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide is sourced from PubChem (CID 102922038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).