1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea

C16H23N3O3 — CID 111474971

IUPAC1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea
SMILESCCCn1ccc2ccc(NC(=O)NCC(O)COC)cc21
InChIInChI=1S/C16H23N3O3/c1-3-7-19-8-6-12-4-5-13(9-15(12)19)18-16(21)17-10-14(20)11-22-2/h4-6,8-9,14,20H,3,7,10-11H2,1-2H3,(H2,17,18,21)
InChIKeyHFRUMDKVBGKHJJ-UHFFFAOYSA-N
MW305.38 g/mol
LogP2.18
Rot. Bonds7

About 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea

1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea (PubChem CID 111474971) has the molecular formula C16H23N3O3 and a molecular weight of 305.38 g/mol. Its IUPAC name is 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea.

Molecular Properties

Compound Name1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea
PubChem CID111474971
Molecular FormulaC16H23N3O3
Molecular Weight305.38 g/mol
Exact Mass305.17
IUPAC Name1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea
SMILESCCCn1ccc2ccc(NC(=O)NCC(O)COC)cc21
InChIInChI=1S/C16H23N3O3/c1-3-7-19-8-6-12-4-5-13(9-15(12)19)18-16(21)17-10-14(20)11-22-2/h4-6,8-9,14,20H,3,7,10-11H2,1-2H3,(H2,17,18,21)
InChIKeyHFRUMDKVBGKHJJ-UHFFFAOYSA-N
XLogP2.18
TPSA75.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 52.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[3-(cyclopropylmethoxy)-2-hydroxypropyl]-3-(1-propylindol-6-yl)urea
CID 111474965
1-(1-ethylindol-6-yl)-3-[2-hydroxy-3-(2-methylpropoxy)propyl]urea
CID 111474953
1-(4-hydroxy-2-methylbutyl)-3-(1-propylindol-6-yl)urea
CID 111474973
2-methyl-3-(methylamino)-N-(1-propylindol-6-yl)propanamide;hydrochloride
CID 119797080
4-amino-3-methoxy-N-(1-propylindol-6-yl)butanamide
CID 120592934
2-amino-2-methyl-N-(1-propylindol-6-yl)propanamide
CID 119331183
2-amino-N-(1-propylindol-6-yl)pentanamide;hydrochloride
CID 119331199
1-(3-bromo-4-chlorophenyl)-3-[(2R)-2-hydroxy-3-methoxypropyl]urea
CID 97054291
1-(3-bromo-4-chlorophenyl)-3-[(2S)-2-hydroxy-3-methoxypropyl]urea
CID 97054292
1-(1-ethylindol-6-yl)-3-[2-(2-fluorophenyl)-2-hydroxyethyl]urea
CID 111446739
3-methylsulfonyl-N-(1-propylindol-6-yl)propanamide
CID 71990600
1-(3-hydroxypropyl)-3-(1-propylindol-5-yl)urea
CID 110936400

Frequently Asked Questions

What is the IUPAC name of 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea?
The IUPAC name of 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea (CID 111474971) is 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea.
What is the SMILES notation for 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea?
The canonical SMILES for 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea is CCCn1ccc2ccc(NC(=O)NCC(O)COC)cc21.
What is the InChIKey of 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea?
The InChIKey is HFRUMDKVBGKHJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O3/c1-3-7-19-8-6-12-4-5-13(9-15(12)19)18-16(21)17-10-14(20)11-22-2/h4-6,8-9,14,20H,3,7,10-11H2,1-2H3,(H2,17,18,21).
What are the key properties of 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea?
1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea has a molecular weight of 305.38 g/mol, XLogP of 2.18, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-hydroxy-3-methoxypropyl)-3-(1-propylindol-6-yl)urea is sourced from PubChem (CID 111474971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).