1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea

C11H16N2O3 — CID 43417318

IUPAC1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)NC(C)CO
InChIInChI=1S/C11H16N2O3/c1-8(7-14)12-11(15)13-9-5-3-4-6-10(9)16-2/h3-6,8,14H,7H2,1-2H3,(H2,12,13,15)
InChIKeyMFEBVAADEYBQFY-UHFFFAOYSA-N
MW224.26 g/mol
LogP1.20
Rot. Bonds4

About 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea

1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea (PubChem CID 43417318) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea.

Molecular Properties

Compound Name1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea
PubChem CID43417318
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)NC(C)CO
InChIInChI=1S/C11H16N2O3/c1-8(7-14)12-11(15)13-9-5-3-4-6-10(9)16-2/h3-6,8,14H,7H2,1-2H3,(H2,12,13,15)
InChIKeyMFEBVAADEYBQFY-UHFFFAOYSA-N
XLogP1.20
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 51.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-hydroxybutan-2-yl)-3-(2-methoxyphenyl)urea
CID 78998444
1-butan-2-yl-3-(2-methoxyphenyl)urea
CID 19167871
1-(2-methoxyphenyl)-3-propan-2-ylurea
CID 19167870
1-(2-methoxyphenyl)-3-pent-4-yn-2-ylurea
CID 115662879
1-(1-cyanoethyl)-3-(2-methoxyphenyl)urea
CID 60969499
2-[(2-methoxyphenyl)carbamoylamino]butanoic acid
CID 43469980
1-(4,5-dichloro-2-methoxyphenyl)-3-[(2S)-1-hydroxypropan-2-yl]urea
CID 99833156
1-[(2S)-1-hydroxypropan-2-yl]-3-[2-(trifluoromethyl)phenyl]urea
CID 79023676
1-(2,3-dimethylphenyl)-3-(1-hydroxypropan-2-yl)urea
CID 110890295
1-(1-hydroxypropan-2-yl)-3-(2-methylsulfonylphenyl)urea
CID 51080334
(2R)-2-bromo-N-(2-methoxyphenyl)propanamide
CID 737002
(2R)-2-chloro-N-(2-methoxyphenyl)propanamide
CID 2490730

Frequently Asked Questions

What is the IUPAC name of 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea?
The IUPAC name of 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea (CID 43417318) is 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea.
What is the SMILES notation for 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea?
The canonical SMILES for 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea is COc1ccccc1NC(=O)NC(C)CO.
What is the InChIKey of 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea?
The InChIKey is MFEBVAADEYBQFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-8(7-14)12-11(15)13-9-5-3-4-6-10(9)16-2/h3-6,8,14H,7H2,1-2H3,(H2,12,13,15).
What are the key properties of 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea?
1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea has a molecular weight of 224.26 g/mol, XLogP of 1.20, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-hydroxypropan-2-yl)-3-(2-methoxyphenyl)urea is sourced from PubChem (CID 43417318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).