1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea

C19H23N3O2 — CID 38887344

IUPAC1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)NC[C@H](C)N1CCc2ccccc21
InChIInChI=1S/C19H23N3O2/c1-14(22-12-11-15-7-3-5-9-17(15)22)13-20-19(23)21-16-8-4-6-10-18(16)24-2/h3-10,14H,11-13H2,1-2H3,(H2,20,21,23)/t14-/m0/s1
InChIKeyNQGMLWUZLDLSSS-AWEZNQCLSA-N
MW325.41 g/mol
LogP3.27
Rot. Bonds5

About 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea

1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea (PubChem CID 38887344) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea.

Molecular Properties

Compound Name1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea
PubChem CID38887344
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea
SMILESCOc1ccccc1NC(=O)NC[C@H](C)N1CCc2ccccc21
InChIInChI=1S/C19H23N3O2/c1-14(22-12-11-15-7-3-5-9-17(15)22)13-20-19(23)21-16-8-4-6-10-18(16)24-2/h3-10,14H,11-13H2,1-2H3,(H2,20,21,23)/t14-/m0/s1
InChIKeyNQGMLWUZLDLSSS-AWEZNQCLSA-N
XLogP3.27
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2,3-dihydroindol-1-yl)propyl]-3-[1-(2-methoxyphenyl)ethyl]urea
CID 78860902
1-(2-methoxyphenyl)-3-[(2R)-2-piperidin-1-ylpropyl]urea
CID 42473211
N-[2-(2,3-dihydroindol-1-yl)propyl]-2-hydroxy-3-methoxybenzamide
CID 112819645
1-[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-3-(2-methoxyphenyl)urea
CID 46383478
1-(4-cyanophenyl)-3-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]urea
CID 38887286
1-[(2R)-2-(2,3-dihydroindol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]-3-(2,3-dimethoxyphenyl)urea
CID 30294616
1-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-3-(2-methoxyphenyl)urea
CID 92881442
1-[1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]-3-(2-methoxyphenyl)urea
CID 46383419
N-[(2R)-2-(2,3-dihydroindol-1-yl)-2-thiophen-2-ylethyl]-N'-(2-methoxyphenyl)oxamide
CID 7179549
(2S)-N-[(2R)-2-(2,3-dihydroindol-1-yl)propyl]-2-methylsulfonylpropanamide
CID 94028724
1-[2-(2,3-dihydroindol-1-yl)propyl]-3-(3-hydroxy-4-methylpentyl)urea
CID 111504884
1-(2-methoxyphenyl)-3-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]urea
CID 17497858

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea?
The IUPAC name of 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea (CID 38887344) is 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea.
What is the SMILES notation for 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea?
The canonical SMILES for 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea is COc1ccccc1NC(=O)NC[C@H](C)N1CCc2ccccc21.
What is the InChIKey of 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea?
The InChIKey is NQGMLWUZLDLSSS-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-14(22-12-11-15-7-3-5-9-17(15)22)13-20-19(23)21-16-8-4-6-10-18(16)24-2/h3-10,14H,11-13H2,1-2H3,(H2,20,21,23)/t14-/m0/s1.
What are the key properties of 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea?
1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea has a molecular weight of 325.41 g/mol, XLogP of 3.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]-3-(2-methoxyphenyl)urea is sourced from PubChem (CID 38887344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).