1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea

C19H24N2O4 — CID 3502987

IUPAC1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea
SMILESCCOc1ccccc1CCNC(=O)Nc1cc(OC)cc(OC)c1
InChIInChI=1S/C19H24N2O4/c1-4-25-18-8-6-5-7-14(18)9-10-20-19(22)21-15-11-16(23-2)13-17(12-15)24-3/h5-8,11-13H,4,9-10H2,1-3H3,(H2,20,21,22)
InChIKeyHFYKQSQQENCUDL-UHFFFAOYSA-N
MW344.41 g/mol
LogP3.47
Rot. Bonds8

About 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea

1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea (PubChem CID 3502987) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea.

Molecular Properties

Compound Name1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea
PubChem CID3502987
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea
SMILESCCOc1ccccc1CCNC(=O)Nc1cc(OC)cc(OC)c1
InChIInChI=1S/C19H24N2O4/c1-4-25-18-8-6-5-7-14(18)9-10-20-19(22)21-15-11-16(23-2)13-17(12-15)24-3/h5-8,11-13H,4,9-10H2,1-3H3,(H2,20,21,22)
InChIKeyHFYKQSQQENCUDL-UHFFFAOYSA-N
XLogP3.47
TPSA68.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-methoxyphenyl)-3-[2-(2-methoxyphenyl)ethyl]urea
CID 2207277
1-[2-(2-ethoxyphenyl)ethyl]-3-(3-iodophenyl)urea
CID 3716045
1-(3-chloro-4-methylphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea
CID 5221281
1-[4-(dimethylamino)phenyl]-3-[2-(2-ethoxyphenyl)ethyl]urea
CID 3552165
1-[2-(3,5-dimethoxyphenoxy)ethyl]-3-[2-(2-methoxyphenyl)ethyl]urea
CID 112975641
1-(3,5-dimethoxyphenyl)-3-[2-(2-methoxyphenyl)ethyl]thiourea
CID 17298438
N'-(2,5-dimethoxyphenyl)-N-[2-(2-ethoxyphenyl)ethyl]propanediamide
CID 50981444
1-[3-(2-ethoxyphenyl)propyl]-3-(2-methoxyphenyl)urea
CID 100747319
1-(2-ethoxyphenyl)-3-[2-(4-methoxyphenyl)ethyl]urea
CID 971052
1-(3-methoxyphenyl)-3-[2-(2-methylphenyl)ethyl]urea
CID 42029830
1-[2-(2-methoxyphenyl)ethyl]-3-(3-methylphenyl)urea
CID 6464688
1-butyl-3-(3,5-dimethoxyphenyl)urea
CID 47103671

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea?
The IUPAC name of 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea (CID 3502987) is 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea.
What is the SMILES notation for 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea?
The canonical SMILES for 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea is CCOc1ccccc1CCNC(=O)Nc1cc(OC)cc(OC)c1.
What is the InChIKey of 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea?
The InChIKey is HFYKQSQQENCUDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-4-25-18-8-6-5-7-14(18)9-10-20-19(22)21-15-11-16(23-2)13-17(12-15)24-3/h5-8,11-13H,4,9-10H2,1-3H3,(H2,20,21,22).
What are the key properties of 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea?
1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea has a molecular weight of 344.41 g/mol, XLogP of 3.47, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethoxyphenyl)-3-[2-(2-ethoxyphenyl)ethyl]urea is sourced from PubChem (CID 3502987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).