N-[3-(2,3-dihydroindol-1-yl)propyl]formamide

C12H16N2O — CID 64990492

IUPACN-[3-(2,3-dihydroindol-1-yl)propyl]formamide
SMILESO=CNCCCN1CCc2ccccc21
InChIInChI=1S/C12H16N2O/c15-10-13-7-3-8-14-9-6-11-4-1-2-5-12(11)14/h1-2,4-5,10H,3,6-9H2,(H,13,15)
InChIKeyRAMGSSNDGJGCBM-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.19
Rot. Bonds5

About N-[3-(2,3-dihydroindol-1-yl)propyl]formamide

N-[3-(2,3-dihydroindol-1-yl)propyl]formamide (PubChem CID 64990492) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is N-[3-(2,3-dihydroindol-1-yl)propyl]formamide.

Molecular Properties

Compound NameN-[3-(2,3-dihydroindol-1-yl)propyl]formamide
PubChem CID64990492
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC NameN-[3-(2,3-dihydroindol-1-yl)propyl]formamide
SMILESO=CNCCCN1CCc2ccccc21
InChIInChI=1S/C12H16N2O/c15-10-13-7-3-8-14-9-6-11-4-1-2-5-12(11)14/h1-2,4-5,10H,3,6-9H2,(H,13,15)
InChIKeyRAMGSSNDGJGCBM-UHFFFAOYSA-N
XLogP1.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[3-(2,3-dihydroindol-1-yl)propyl]formamide 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-[3-(2,3-dihydroindol-1-yl)propyl]prop-2-enamide
CID 61251337
N-[3-(2,3-dihydroindol-1-yl)propyl]cyclopropanamine
CID 60867490
3-(2,3-dihydroindol-1-yl)-N-(2-methoxyethyl)propan-1-amine
CID 62569832
3-[3-(2,3-dihydroindol-1-yl)propylamino]-3-oxopropanoic acid
CID 62230278
1-butyl-2,3-dihydroindole
CID 4167209
N-[(4-chlorophenyl)methyl]-3-(2,3-dihydroindol-1-yl)propan-1-amine
CID 29275975
3-amino-N-[3-(2,3-dihydroindol-1-yl)propyl]propanamide;dihydrochloride
CID 119851222
3-(2,3-dihydroindol-1-yl)-N-(furan-2-ylmethyl)propan-1-amine
CID 43208035
2-amino-N-[3-(2,3-dihydroindol-1-yl)propyl]propanamide
CID 61274113
N-[3-(2,3-dihydroindol-1-yl)propyl]-1-ethylsulfonylpropan-2-amine
CID 115900693
3-chloro-N-[3-(2,3-dihydroindol-1-yl)propyl]propane-1-sulfonamide
CID 61248393
3-(2,3-dihydroindol-1-yl)-N-[(5-methyloxolan-2-yl)methyl]propan-1-amine
CID 82833789

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,3-dihydroindol-1-yl)propyl]formamide?
The IUPAC name of N-[3-(2,3-dihydroindol-1-yl)propyl]formamide (CID 64990492) is N-[3-(2,3-dihydroindol-1-yl)propyl]formamide.
What is the SMILES notation for N-[3-(2,3-dihydroindol-1-yl)propyl]formamide?
The canonical SMILES for N-[3-(2,3-dihydroindol-1-yl)propyl]formamide is O=CNCCCN1CCc2ccccc21.
What is the InChIKey of N-[3-(2,3-dihydroindol-1-yl)propyl]formamide?
The InChIKey is RAMGSSNDGJGCBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c15-10-13-7-3-8-14-9-6-11-4-1-2-5-12(11)14/h1-2,4-5,10H,3,6-9H2,(H,13,15).
What are the key properties of N-[3-(2,3-dihydroindol-1-yl)propyl]formamide?
N-[3-(2,3-dihydroindol-1-yl)propyl]formamide has a molecular weight of 204.27 g/mol, XLogP of 1.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,3-dihydroindol-1-yl)propyl]formamide is sourced from PubChem (CID 64990492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).