5-[(1-methylindol-3-yl)methylamino]pentanamide

C15H21N3O — CID 106233935

IUPAC5-[(1-methylindol-3-yl)methylamino]pentanamide
SMILESCn1cc(CNCCCCC(N)=O)c2ccccc21
InChIInChI=1S/C15H21N3O/c1-18-11-12(13-6-2-3-7-14(13)18)10-17-9-5-4-8-15(16)19/h2-3,6-7,11,17H,4-5,8-10H2,1H3,(H2,16,19)
InChIKeyRYHIRKCUEZOWKT-UHFFFAOYSA-N
MW259.35 g/mol
LogP1.92
Rot. Bonds7

About 5-[(1-methylindol-3-yl)methylamino]pentanamide

5-[(1-methylindol-3-yl)methylamino]pentanamide (PubChem CID 106233935) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 5-[(1-methylindol-3-yl)methylamino]pentanamide.

Molecular Properties

Compound Name5-[(1-methylindol-3-yl)methylamino]pentanamide
PubChem CID106233935
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name5-[(1-methylindol-3-yl)methylamino]pentanamide
SMILESCn1cc(CNCCCCC(N)=O)c2ccccc21
InChIInChI=1S/C15H21N3O/c1-18-11-12(13-6-2-3-7-14(13)18)10-17-9-5-4-8-15(16)19/h2-3,6-7,11,17H,4-5,8-10H2,1H3,(H2,16,19)
InChIKeyRYHIRKCUEZOWKT-UHFFFAOYSA-N
XLogP1.92
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-[(1-methylindol-3-yl)methylamino]pentanamide 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

ethyl 4-[(1-methylindol-3-yl)methylamino]butanoate
CID 65072383
6-[(1-methylindol-3-yl)methylamino]hexan-1-ol
CID 107849119
4-(1-methylindol-3-yl)butanamide
CID 175206986
3-[(1-methylindol-3-yl)methylamino]propane-1-sulfonamide
CID 107235566
N-[(1-methylindol-3-yl)methyl]-4-methylsulfanylbutan-1-amine
CID 107236224
3-[(1-methylindol-3-yl)methylamino]-N-propylpropanamide
CID 107235569
5-[(1,3-dimethylindol-2-yl)methylamino]pentanamide
CID 106233704
3-[3-[(3-pyridin-4-ylpropylamino)methyl]indol-1-yl]propanamide
CID 46987148
3-[3-[(3-pyridin-3-yloxypropylamino)methyl]indol-1-yl]propanamide
CID 46985288
N'-methyl-N-[(1-methylindol-3-yl)methyl]-N'-propan-2-ylpropane-1,3-diamine
CID 106040437
N-methyl-N'-[(1-methylindol-3-yl)methyl]methanediamine
CID 115226846
N-[(1-methylindol-3-yl)methyl]-3-(2-methylpropoxy)propan-1-amine
CID 107234778

Frequently Asked Questions

What is the IUPAC name of 5-[(1-methylindol-3-yl)methylamino]pentanamide?
The IUPAC name of 5-[(1-methylindol-3-yl)methylamino]pentanamide (CID 106233935) is 5-[(1-methylindol-3-yl)methylamino]pentanamide.
What is the SMILES notation for 5-[(1-methylindol-3-yl)methylamino]pentanamide?
The canonical SMILES for 5-[(1-methylindol-3-yl)methylamino]pentanamide is Cn1cc(CNCCCCC(N)=O)c2ccccc21.
What is the InChIKey of 5-[(1-methylindol-3-yl)methylamino]pentanamide?
The InChIKey is RYHIRKCUEZOWKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-18-11-12(13-6-2-3-7-14(13)18)10-17-9-5-4-8-15(16)19/h2-3,6-7,11,17H,4-5,8-10H2,1H3,(H2,16,19).
What are the key properties of 5-[(1-methylindol-3-yl)methylamino]pentanamide?
5-[(1-methylindol-3-yl)methylamino]pentanamide has a molecular weight of 259.35 g/mol, XLogP of 1.92, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-methylindol-3-yl)methylamino]pentanamide is sourced from PubChem (CID 106233935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).