1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea

C18H26N4O3 — CID 124845688

IUPAC1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea
SMILESCCc1onc(C)c1NC(=O)N[C@@H](CN(C)C)c1ccc(OC)cc1
InChIInChI=1S/C18H26N4O3/c1-6-16-17(12(2)21-25-16)20-18(23)19-15(11-22(3)4)13-7-9-14(24-5)10-8-13/h7-10,15H,6,11H2,1-5H3,(H2,19,20,23)/t15-/m0/s1
InChIKeyHROOBHNSIMFAIQ-HNNXBMFYSA-N
MW346.43 g/mol
LogP2.98
Rot. Bonds7

About 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea

1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea (PubChem CID 124845688) has the molecular formula C18H26N4O3 and a molecular weight of 346.43 g/mol. Its IUPAC name is 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea.

Molecular Properties

Compound Name1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea
PubChem CID124845688
Molecular FormulaC18H26N4O3
Molecular Weight346.43 g/mol
Exact Mass346.20
IUPAC Name1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea
SMILESCCc1onc(C)c1NC(=O)N[C@@H](CN(C)C)c1ccc(OC)cc1
InChIInChI=1S/C18H26N4O3/c1-6-16-17(12(2)21-25-16)20-18(23)19-15(11-22(3)4)13-7-9-14(24-5)10-8-13/h7-10,15H,6,11H2,1-5H3,(H2,19,20,23)/t15-/m0/s1
InChIKeyHROOBHNSIMFAIQ-HNNXBMFYSA-N
XLogP2.98
TPSA79.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea 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

1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5,6-dimethylpyridazin-3-yl)urea
CID 122132883
1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(4-methoxypyrimidin-5-yl)urea
CID 129486430
1-(5-ethyl-3-methyl-1,2-oxazol-4-yl)-3-[(2S)-1-hydroxy-3-phenylpropan-2-yl]urea
CID 97062858
methyl (3R)-3-(4-methoxyphenyl)-3-[(5-methyl-1,2-oxazol-3-yl)carbamoylamino]propanoate
CID 97185103
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[1-(4-methoxyphenyl)propyl]acetamide
CID 43027694
N-[(1R)-1,2-bis(4-methoxyphenyl)ethyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 40812290
N-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-5-propan-2-yl-1,3,4-thiadiazole-2-carboxamide
CID 167766652
1-[(1S)-1-(4-methoxyphenyl)propyl]-3-(1,3,4-thiadiazol-2-yl)urea
CID 94024674
ethyl (2R)-3-(dimethylamino)-2-(4-methoxyphenyl)propanoate
CID 76958549
1-[1-(4-methoxyphenyl)ethyl]-3-(5-methyl-1,2-oxazol-3-yl)urea
CID 108812106
ethyl 3-(dimethylamino)-2-(4-methoxyphenyl)propanoate;hydrochloride
CID 129318515
1-(4-methoxyphenyl)-3-(1-phenylpropyl)urea
CID 6469359

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea?
The IUPAC name of 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea (CID 124845688) is 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea.
What is the SMILES notation for 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea?
The canonical SMILES for 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea is CCc1onc(C)c1NC(=O)N[C@@H](CN(C)C)c1ccc(OC)cc1.
What is the InChIKey of 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea?
The InChIKey is HROOBHNSIMFAIQ-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H26N4O3/c1-6-16-17(12(2)21-25-16)20-18(23)19-15(11-22(3)4)13-7-9-14(24-5)10-8-13/h7-10,15H,6,11H2,1-5H3,(H2,19,20,23)/t15-/m0/s1.
What are the key properties of 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea?
1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea has a molecular weight of 346.43 g/mol, XLogP of 2.98, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-3-(5-ethyl-3-methyl-1,2-oxazol-4-yl)urea is sourced from PubChem (CID 124845688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).