1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea

C17H22N2O2 — CID 3823639

IUPAC1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea
SMILESCCCN(CCOC)C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C17H22N2O2/c1-3-11-19(12-13-21-2)17(20)18-16-10-6-8-14-7-4-5-9-15(14)16/h4-10H,3,11-13H2,1-2H3,(H,18,20)
InChIKeyVZUGOJXYNXBINH-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.73
Rot. Bonds6

About 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea

1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea (PubChem CID 3823639) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea.

Molecular Properties

Compound Name1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea
PubChem CID3823639
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea
SMILESCCCN(CCOC)C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C17H22N2O2/c1-3-11-19(12-13-21-2)17(20)18-16-10-6-8-14-7-4-5-9-15(14)16/h4-10H,3,11-13H2,1-2H3,(H,18,20)
InChIKeyVZUGOJXYNXBINH-UHFFFAOYSA-N
XLogP3.73
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-tert-butylphenyl)-1-(2-methoxyethyl)-1-propylurea
CID 3850289
[3-[[2-methoxyethyl(naphthalen-1-ylcarbamoyl)amino]methyl]phenyl] methanesulfonate
CID 42775572
3-naphthalen-1-yl-1,1-dipropylthiourea
CID 19653014
methyl 2-[[naphthalen-1-ylcarbamoyl(propyl)amino]methyl]-1,3-thiazole-4-carboxylate
CID 1196447
1-ethyl-3-naphthalen-1-yl-1-[2-(naphthalen-1-ylcarbamoylamino)ethyl]urea
CID 4067846
1,1-bis(2-methylpropyl)-3-naphthalen-1-ylurea
CID 19835720
1-ethyl-1-(2-hydroxy-2-methylpropyl)-3-naphthalen-1-ylurea
CID 79378172
3-(2,6-dichloro-4-pyridinyl)-1-(2-methoxyethyl)-1-propylurea
CID 3738621
1-(3-amino-3-hydroxyiminopropyl)-3-(2-fluorophenyl)-1-(2-methoxyethyl)urea
CID 76993854
ethyl 3-[(2-methoxyphenyl)carbamoyl-propylamino]propanoate
CID 42697935
N-[3-tert-butyl-1-(4-methylphenyl)pyrazol-5-yl]-2-[2-methoxyethyl(naphthalen-1-ylcarbamoyl)amino]acetamide
CID 4551609
1,1-bis(2-methoxyethyl)-3-(4-phenylphenyl)urea
CID 108867129

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea?
The IUPAC name of 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea (CID 3823639) is 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea.
What is the SMILES notation for 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea?
The canonical SMILES for 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea is CCCN(CCOC)C(=O)Nc1cccc2ccccc12.
What is the InChIKey of 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea?
The InChIKey is VZUGOJXYNXBINH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-3-11-19(12-13-21-2)17(20)18-16-10-6-8-14-7-4-5-9-15(14)16/h4-10H,3,11-13H2,1-2H3,(H,18,20).
What are the key properties of 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea?
1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea has a molecular weight of 286.38 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-3-naphthalen-1-yl-1-propylurea is sourced from PubChem (CID 3823639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).