N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide

C17H23N3O3 — CID 111435467

IUPACN-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide
SMILESCC(C)Cn1ccc2cc(NC(=O)C(=O)NCC(C)O)ccc21
InChIInChI=1S/C17H23N3O3/c1-11(2)10-20-7-6-13-8-14(4-5-15(13)20)19-17(23)16(22)18-9-12(3)21/h4-8,11-12,21H,9-10H2,1-3H3,(H,18,22)(H,19,23)
InChIKeyZEVDYVARCCZRQZ-UHFFFAOYSA-N
MW317.39 g/mol
LogP1.73
Rot. Bonds5

About N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide

N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide (PubChem CID 111435467) has the molecular formula C17H23N3O3 and a molecular weight of 317.39 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide
PubChem CID111435467
Molecular FormulaC17H23N3O3
Molecular Weight317.39 g/mol
Exact Mass317.17
IUPAC NameN-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide
SMILESCC(C)Cn1ccc2cc(NC(=O)C(=O)NCC(C)O)ccc21
InChIInChI=1S/C17H23N3O3/c1-11(2)10-20-7-6-13-8-14(4-5-15(13)20)19-17(23)16(22)18-9-12(3)21/h4-8,11-12,21H,9-10H2,1-3H3,(H,18,22)(H,19,23)
InChIKeyZEVDYVARCCZRQZ-UHFFFAOYSA-N
XLogP1.73
TPSA83.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 51.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide 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

N-[(2R,3R)-2-hydroxy-3-methylpentyl]-N'-(1-propylindol-5-yl)oxamide
CID 95773561
N-[1-(2-methylpropyl)indol-5-yl]pyrrolidine-1-carboxamide
CID 52865791
1-[2-(3,4-difluorophenyl)-2-hydroxyethyl]-3-[1-(2-methylpropyl)indol-5-yl]urea
CID 51134217
N-[1-(2-methylpropyl)indol-5-yl]thiomorpholine-4-carboxamide
CID 52865783
1-(1-hydroxy-2-methylpropan-2-yl)-3-[1-(2-methylpropyl)indol-5-yl]urea
CID 111976911
3-[2-[[1-(2-methylpropyl)indol-5-yl]amino]-2-oxoethyl]imidazole-4-carboxylic acid
CID 166303690
1-[2-(2,4-difluorophenyl)-2-hydroxyethyl]-3-[1-(2-methylpropyl)indol-5-yl]urea
CID 56528086
2-hydroxy-N-[1-(2-methylpropyl)indol-5-yl]cyclopentane-1-carboxamide
CID 110014325
4-(hydroxymethyl)-N-[1-(2-methylpropyl)indol-5-yl]piperidine-1-carboxamide
CID 110936365
3-(hydroxymethyl)-N-[1-(2-methylpropyl)indol-5-yl]pyrrolidine-1-carboxamide
CID 111443241
1-[1-(2-methylpropyl)indol-5-yl]-3-(thiophen-3-ylmethyl)urea
CID 56528070
4-(4-methoxyphenyl)-N-[1-(2-methylpropyl)indol-5-yl]piperazine-1-carboxamide
CID 56527612

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide?
The IUPAC name of N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide (CID 111435467) is N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide?
The canonical SMILES for N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide is CC(C)Cn1ccc2cc(NC(=O)C(=O)NCC(C)O)ccc21.
What is the InChIKey of N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide?
The InChIKey is ZEVDYVARCCZRQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O3/c1-11(2)10-20-7-6-13-8-14(4-5-15(13)20)19-17(23)16(22)18-9-12(3)21/h4-8,11-12,21H,9-10H2,1-3H3,(H,18,22)(H,19,23).
What are the key properties of N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide?
N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide has a molecular weight of 317.39 g/mol, XLogP of 1.73, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-N'-[1-(2-methylpropyl)indol-5-yl]oxamide is sourced from PubChem (CID 111435467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).