1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea

C15H24N2O2 — CID 115660984

IUPAC1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea
SMILESCCCNC(=O)N(C)C(C)Cc1ccccc1OC
InChIInChI=1S/C15H24N2O2/c1-5-10-16-15(18)17(3)12(2)11-13-8-6-7-9-14(13)19-4/h6-9,12H,5,10-11H2,1-4H3,(H,16,18)
InChIKeyGDMAAWHLHVYKEY-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.68
Rot. Bonds6

About 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea

1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea (PubChem CID 115660984) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea.

Molecular Properties

Compound Name1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea
PubChem CID115660984
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea
SMILESCCCNC(=O)N(C)C(C)Cc1ccccc1OC
InChIInChI=1S/C15H24N2O2/c1-5-10-16-15(18)17(3)12(2)11-13-8-6-7-9-14(13)19-4/h6-9,12H,5,10-11H2,1-4H3,(H,16,18)
InChIKeyGDMAAWHLHVYKEY-UHFFFAOYSA-N
XLogP2.68
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-1-[1-(2-methoxyphenyl)propan-2-yl]-1-methylurea
CID 71994436
methyl 2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]-2-oxoacetate
CID 112617368
2-chloro-N-[1-(2-methoxyphenyl)propan-2-yl-methylcarbamoyl]propanamide
CID 65488311
2-[1-(2-methoxyphenyl)propan-2-ylamino]-N-propylacetamide
CID 43777802
3-(ethylamino)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpropanamide
CID 65488019
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylpyrrolidine-1-carboxamide
CID 115665268
3-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methyl-3-sulfanylidenepropanamide
CID 65486697
N-(cyanomethyl)-N'-[1-(2-methoxyphenyl)propan-2-yl]-N'-methyloxamide
CID 65486876
2-amino-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide;hydrochloride
CID 119319100
2-methoxy-N-[1-(2-methoxyphenyl)propan-2-yl]-N,2-dimethylpropanamide
CID 103029189
2-[1-(2-methoxyphenyl)propan-2-yl-methylamino]propanehydrazide
CID 65486572
3-N-[1-(2-methoxyphenyl)propan-2-yl]-3-N-methyl-2-N-propylbutane-2,3-diamine
CID 65487593

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea?
The IUPAC name of 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea (CID 115660984) is 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea.
What is the SMILES notation for 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea?
The canonical SMILES for 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea is CCCNC(=O)N(C)C(C)Cc1ccccc1OC.
What is the InChIKey of 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea?
The InChIKey is GDMAAWHLHVYKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-5-10-16-15(18)17(3)12(2)11-13-8-6-7-9-14(13)19-4/h6-9,12H,5,10-11H2,1-4H3,(H,16,18).
What are the key properties of 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea?
1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea has a molecular weight of 264.37 g/mol, XLogP of 2.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methoxyphenyl)propan-2-yl]-1-methyl-3-propylurea is sourced from PubChem (CID 115660984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).