6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione

C15H19N3O3 — CID 51073803

IUPAC6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione
SMILESCc1ccccc1OCCN(C)Cc1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C15H19N3O3/c1-11-5-3-4-6-13(11)21-8-7-18(2)10-12-9-14(19)17-15(20)16-12/h3-6,9H,7-8,10H2,1-2H3,(H2,16,17,19,20)
InChIKeyLVMVLFXNNYTHFO-UHFFFAOYSA-N
MW289.33 g/mol
LogP0.88
Rot. Bonds6

About 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione

6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione (PubChem CID 51073803) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione
PubChem CID51073803
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione
SMILESCc1ccccc1OCCN(C)Cc1cc(=O)[nH]c(=O)[nH]1
InChIInChI=1S/C15H19N3O3/c1-11-5-3-4-6-13(11)21-8-7-18(2)10-12-9-14(19)17-15(20)16-12/h3-6,9H,7-8,10H2,1-2H3,(H2,16,17,19,20)
InChIKeyLVMVLFXNNYTHFO-UHFFFAOYSA-N
XLogP0.88
TPSA78.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione 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

3-[methyl-[2-(2-methylphenoxy)ethyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)propanamide
CID 35799341
N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]-2-(2,3-dimethylphenoxy)-N-methylethanamine
CID 50965380
4-[methyl-[2-(2-methylphenoxy)ethyl]amino]butan-2-ol
CID 111488563
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-methyl-N-[2-(2-methylphenoxy)ethyl]ethanamine
CID 28910618
2-[methyl-[3-(2-methylphenoxy)propyl]amino]ethanol
CID 110908229
N-cyclopropyl-2-[methyl-[2-(2-methylphenoxy)ethyl]amino]acetamide
CID 8909311
N-methyl-N-[2-(2-methylphenoxy)ethyl]butanamide
CID 60675961
N-methyl-N-[2-(2-methylphenoxy)ethyl]-3-oxobutanamide
CID 54876653
2-chloro-N-methyl-N-[2-(2-methylphenoxy)ethyl]-1,3-thiazole-5-sulfonamide
CID 61042544
1-fluoro-4-[2-(2-methylphenoxy)ethoxy]benzene
CID 59416560
ethyl 6-methyl-2-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-4-oxo-3H-furo[2,3-d]pyrimidine-5-carboxylate
CID 24507547
4-chloro-N-methyl-N-[2-(2-methylphenoxy)ethyl]-1H-pyrrole-2-carboxamide
CID 18120198

Frequently Asked Questions

What is the IUPAC name of 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione?
The IUPAC name of 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione (CID 51073803) is 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione?
The canonical SMILES for 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione is Cc1ccccc1OCCN(C)Cc1cc(=O)[nH]c(=O)[nH]1.
What is the InChIKey of 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione?
The InChIKey is LVMVLFXNNYTHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-11-5-3-4-6-13(11)21-8-7-18(2)10-12-9-14(19)17-15(20)16-12/h3-6,9H,7-8,10H2,1-2H3,(H2,16,17,19,20).
What are the key properties of 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione?
6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione has a molecular weight of 289.33 g/mol, XLogP of 0.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[methyl-[2-(2-methylphenoxy)ethyl]amino]methyl]-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 51073803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).