1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea

C16H22N4O4 — CID 122150088

IUPAC1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea
SMILESCc1cc(NC(=O)NCCN2C(=O)CNC2=O)ccc1OC(C)C
InChIInChI=1S/C16H22N4O4/c1-10(2)24-13-5-4-12(8-11(13)3)19-15(22)17-6-7-20-14(21)9-18-16(20)23/h4-5,8,10H,6-7,9H2,1-3H3,(H,18,23)(H2,17,19,22)
InChIKeyGKXNTFRTAXLWCV-UHFFFAOYSA-N
MW334.38 g/mol
LogP1.46
Rot. Bonds6

About 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea

1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea (PubChem CID 122150088) has the molecular formula C16H22N4O4 and a molecular weight of 334.38 g/mol. Its IUPAC name is 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea.

Molecular Properties

Compound Name1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea
PubChem CID122150088
Molecular FormulaC16H22N4O4
Molecular Weight334.38 g/mol
Exact Mass334.16
IUPAC Name1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea
SMILESCc1cc(NC(=O)NCCN2C(=O)CNC2=O)ccc1OC(C)C
InChIInChI=1S/C16H22N4O4/c1-10(2)24-13-5-4-12(8-11(13)3)19-15(22)17-6-7-20-14(21)9-18-16(20)23/h4-5,8,10H,6-7,9H2,1-3H3,(H,18,23)(H2,17,19,22)
InChIKeyGKXNTFRTAXLWCV-UHFFFAOYSA-N
XLogP1.46
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)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

4-[(3-methyl-4-propan-2-yloxyphenyl)carbamoylamino]butanoic acid
CID 122085552
4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide
CID 167745572
N-(3,4-dimethylphenyl)-2-(2,5-dioxoimidazolidin-1-yl)acetamide
CID 110686754
1-(3-methyl-4-propan-2-yloxyphenyl)-3-propan-2-ylurea
CID 110774552
2-amino-N-(3-methyl-4-propan-2-yloxyphenyl)acetamide
CID 82494452
2-(cyclopropylmethylamino)-N-(3-methyl-4-propan-2-yloxyphenyl)acetamide
CID 119802601
2-hydroxy-2-methyl-3-[(3-methyl-4-propan-2-yloxyphenyl)carbamoylamino]propanoic acid
CID 122085546
1-[(4-cyclopropyl-1,2,4-triazol-3-yl)methyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea
CID 71857838
4-(methylamino)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide
CID 119802582
1-(1-methoxypropan-2-yl)-3-(3-methyl-4-propan-2-yloxyphenyl)urea
CID 71991952
N-(3,4-dimethoxyphenyl)-2-(2,5-dioxoimidazolidin-1-yl)acetamide
CID 110686783
N-(3-methyl-4-propan-2-yloxyphenyl)-3-piperidin-4-ylbutanamide
CID 119802609

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea?
The IUPAC name of 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea (CID 122150088) is 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea.
What is the SMILES notation for 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea?
The canonical SMILES for 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea is Cc1cc(NC(=O)NCCN2C(=O)CNC2=O)ccc1OC(C)C.
What is the InChIKey of 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea?
The InChIKey is GKXNTFRTAXLWCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4O4/c1-10(2)24-13-5-4-12(8-11(13)3)19-15(22)17-6-7-20-14(21)9-18-16(20)23/h4-5,8,10H,6-7,9H2,1-3H3,(H,18,23)(H2,17,19,22).
What are the key properties of 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea?
1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea has a molecular weight of 334.38 g/mol, XLogP of 1.46, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea is sourced from PubChem (CID 122150088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).