1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea

C18H24N2O2 — CID 23360900

IUPAC1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea
SMILESCCNC(=O)NCCc1cc(CC)cc2ccc(OC)cc12
InChIInChI=1S/C18H24N2O2/c1-4-13-10-14-6-7-16(22-3)12-17(14)15(11-13)8-9-20-18(21)19-5-2/h6-7,10-12H,4-5,8-9H2,1-3H3,(H2,19,20,21)
InChIKeyFWWXWIQPCHGZGP-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.27
Rot. Bonds6

About 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea

1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea (PubChem CID 23360900) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea.

Molecular Properties

Compound Name1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea
PubChem CID23360900
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea
SMILESCCNC(=O)NCCc1cc(CC)cc2ccc(OC)cc12
InChIInChI=1S/C18H24N2O2/c1-4-13-10-14-6-7-16(22-3)12-17(14)15(11-13)8-9-20-18(21)19-5-2/h6-7,10-12H,4-5,8-9H2,1-3H3,(H2,19,20,21)
InChIKeyFWWXWIQPCHGZGP-UHFFFAOYSA-N
XLogP3.27
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]-3-propylurea
CID 23360827
1-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]-3-hexylurea
CID 23360895
1-cyclohexyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea
CID 23360949
N-[2-[3-(hydroxymethyl)-7-methoxynaphthalen-1-yl]ethyl]acetamide
CID 25167837
1-[2-[3-(cyclopropanecarbonyl)-7-methoxynaphthalen-1-yl]ethyl]-3-propylurea
CID 23360854
N-[2-(3-bromo-7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 12985488
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 139057200
methanol;N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide
CID 174597749
N-[2-[7-methoxy-3-[3-(methylamino)phenyl]naphthalen-1-yl]ethyl]acetamide
CID 44579115
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;sulfuric acid
CID 71529133
3-[2-(ethylcarbamoylamino)ethyl]-5-methoxy-N-methyl-1H-indole-2-carboxamide
CID 118071542
N-[2-(7-methoxynaphthalen-1-yl)ethyl]acetamide;propanedioic acid
CID 71477284

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea?
The IUPAC name of 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea (CID 23360900) is 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea.
What is the SMILES notation for 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea?
The canonical SMILES for 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea is CCNC(=O)NCCc1cc(CC)cc2ccc(OC)cc12.
What is the InChIKey of 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea?
The InChIKey is FWWXWIQPCHGZGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-4-13-10-14-6-7-16(22-3)12-17(14)15(11-13)8-9-20-18(21)19-5-2/h6-7,10-12H,4-5,8-9H2,1-3H3,(H2,19,20,21).
What are the key properties of 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea?
1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea has a molecular weight of 300.40 g/mol, XLogP of 3.27, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-[2-(3-ethyl-7-methoxynaphthalen-1-yl)ethyl]urea is sourced from PubChem (CID 23360900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).