N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide

C16H19N3O2 — CID 92648552

IUPACN-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide
SMILESCOc1ccccc1[C@@H](C)NC(=O)c1cnc(C)nc1C
InChIInChI=1S/C16H19N3O2/c1-10(13-7-5-6-8-15(13)21-4)19-16(20)14-9-17-12(3)18-11(14)2/h5-10H,1-4H3,(H,19,20)/t10-/m1/s1
InChIKeyLCEXIRHRUHKPAD-SNVBAGLBSA-N
MW285.35 g/mol
LogP2.59
Rot. Bonds4

About N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide

N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide (PubChem CID 92648552) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide
PubChem CID92648552
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC NameN-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide
SMILESCOc1ccccc1[C@@H](C)NC(=O)c1cnc(C)nc1C
InChIInChI=1S/C16H19N3O2/c1-10(13-7-5-6-8-15(13)21-4)19-16(20)14-9-17-12(3)18-11(14)2/h5-10H,1-4H3,(H,19,20)/t10-/m1/s1
InChIKeyLCEXIRHRUHKPAD-SNVBAGLBSA-N
XLogP2.59
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-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

N-[1-(2-methoxyphenyl)ethyl]-2-methyl-6-phenylpyridine-3-carboxamide
CID 42922646
N-[(1R)-1-(4-chlorophenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide
CID 92648544
1-(2-fluorophenyl)-N-[1-(2-methoxyphenyl)ethyl]-5-methylpyrazole-4-carboxamide
CID 78840043
N-benzhydryl-2,4-dimethylpyrimidine-5-carboxamide
CID 92648536
2-methoxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 18111879
N-[1-(2-methoxyphenyl)ethyl]-2-methylquinoline-4-carboxamide
CID 4883107
N-[(1S)-1-(2-methoxyphenyl)ethyl]-2,5-dimethylbenzamide
CID 2473869
N-[1-(2-methoxyphenyl)ethyl]quinoline-4-carboxamide
CID 78814424
3-chloro-N-[1-(2-methoxyphenyl)ethyl]pyridine-4-carboxamide
CID 66462846
N-[(1R)-1-(2-methoxyphenyl)ethyl]-2-(methylamino)benzamide
CID 81390779
5,6-dichloro-N-[(1S)-1-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 7936550
N-[1-(2-methoxyphenyl)ethyl]-2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzamide
CID 43043831

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide?
The IUPAC name of N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide (CID 92648552) is N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide.
What is the SMILES notation for N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide?
The canonical SMILES for N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide is COc1ccccc1[C@@H](C)NC(=O)c1cnc(C)nc1C.
What is the InChIKey of N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide?
The InChIKey is LCEXIRHRUHKPAD-SNVBAGLBSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10(13-7-5-6-8-15(13)21-4)19-16(20)14-9-17-12(3)18-11(14)2/h5-10H,1-4H3,(H,19,20)/t10-/m1/s1.
What are the key properties of N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide?
N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(2-methoxyphenyl)ethyl]-2,4-dimethylpyrimidine-5-carboxamide is sourced from PubChem (CID 92648552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).