1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea

C16H18N4O2 — CID 2810883

IUPAC1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
SMILESO=C(NCCN1CCNC1=O)Nc1cccc2ccccc12
InChIInChI=1S/C16H18N4O2/c21-15(17-8-10-20-11-9-18-16(20)22)19-14-7-3-5-12-4-1-2-6-13(12)14/h1-7H,8-11H2,(H,18,22)(H2,17,19,21)
InChIKeyVUIQXPOJBFJCKJ-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.99
Rot. Bonds4

About 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea

1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea (PubChem CID 2810883) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea.

Molecular Properties

Compound Name1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
PubChem CID2810883
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Name1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
SMILESO=C(NCCN1CCNC1=O)Nc1cccc2ccccc12
InChIInChI=1S/C16H18N4O2/c21-15(17-8-10-20-11-9-18-16(20)22)19-14-7-3-5-12-4-1-2-6-13(12)14/h1-7H,8-11H2,(H,18,22)(H2,17,19,21)
InChIKeyVUIQXPOJBFJCKJ-UHFFFAOYSA-N
XLogP1.99
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(aziridin-1-yl)ethyl]-3-naphthalen-1-ylurea
CID 598105
4-naphthalen-1-yl-4-oxo-N-[2-(2-oxoimidazolidin-1-yl)ethyl]butanamide
CID 91770785
1-(2,1,3-benzothiadiazol-4-yl)-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 72882799
1-[2-(1-methylpiperidin-4-yl)oxyphenyl]-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 118772403
1-naphthalen-1-yl-3-(2-pyrazol-1-ylethyl)urea
CID 19589685
1-naphthalen-1-yl-3-(3-oxobutyl)urea
CID 108895153
1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-[3-(sulfamoylmethyl)phenyl]urea
CID 72931818
1-[2-(2-oxoimidazolidin-1-yl)ethyl]-3-(4-phenylmethoxyphenyl)urea
CID 2810884
1-(2-benzylpyrazol-3-yl)-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea
CID 72888153
1-(3-amino-3-sulfanylidenepropyl)-3-naphthalen-1-ylurea
CID 62667648
N-[2-(2-oxoimidazolidin-1-yl)ethyl]-1-benzofuran-2-carboxamide
CID 90649233
1-[4-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]butyl]-3-naphthalen-1-ylurea
CID 95318276

Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea?
The IUPAC name of 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea (CID 2810883) is 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea.
What is the SMILES notation for 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea?
The canonical SMILES for 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea is O=C(NCCN1CCNC1=O)Nc1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea?
The InChIKey is VUIQXPOJBFJCKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c21-15(17-8-10-20-11-9-18-16(20)22)19-14-7-3-5-12-4-1-2-6-13(12)14/h1-7H,8-11H2,(H,18,22)(H2,17,19,21).
What are the key properties of 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea?
1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea has a molecular weight of 298.35 g/mol, XLogP of 1.99, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]urea is sourced from PubChem (CID 2810883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).