3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine

C16H23N3 — CID 83983697

IUPAC3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine
SMILESCCn1cc(CCCNC)c2cc3c(cc21)CNC3
InChIInChI=1S/C16H23N3/c1-3-19-11-12(5-4-6-17-2)15-7-13-9-18-10-14(13)8-16(15)19/h7-8,11,17-18H,3-6,9-10H2,1-2H3
InChIKeyFIFXOLHDTMQDSQ-UHFFFAOYSA-N
MW257.38 g/mol
LogP2.42
Rot. Bonds5

About 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine

3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine (PubChem CID 83983697) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine
PubChem CID83983697
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC Name3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine
SMILESCCn1cc(CCCNC)c2cc3c(cc21)CNC3
InChIInChI=1S/C16H23N3/c1-3-19-11-12(5-4-6-17-2)15-7-13-9-18-10-14(13)8-16(15)19/h7-8,11,17-18H,3-6,9-10H2,1-2H3
InChIKeyFIFXOLHDTMQDSQ-UHFFFAOYSA-N
XLogP2.42
TPSA28.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine 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

3-[1-ethyl-5-(trifluoromethyl)indol-3-yl]-N-methylpropan-1-amine
CID 117195467
1-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)propan-1-amine
CID 83983667
4-(1-ethyl-6-methyl-5,7-dihydropyrrolo[3,4-f]indol-3-yl)butan-2-one
CID 112540759
tert-butyl N-[(1-propyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)methyl]carbamate
CID 83983745
3-(5-ethoxy-1-methylindol-3-yl)-N-methylpropan-1-amine
CID 98784252
4-(1-methyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)butan-2-one
CID 83983649
3-(6-ethyl-2,3-dihydro-[1,4]dioxino[2,3-f]indol-8-yl)propan-1-amine
CID 83948412
1-ethyl-6-methoxy-3-(3-piperazin-1-ylpropyl)indole
CID 83949003
3-(6-ethyl-1,2-dimethyl-5,7-dihydropyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine
CID 112540939
2-(6-methyl-1-propyl-5,7-dihydropyrrolo[3,4-f]indol-3-yl)ethanol
CID 112540741
1-(1-methyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)butan-2-amine
CID 83983625
N-methyl-3-(1-methyl-5-propan-2-ylindol-3-yl)propan-1-amine
CID 96674945

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine?
The IUPAC name of 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine (CID 83983697) is 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine?
The canonical SMILES for 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine is CCn1cc(CCCNC)c2cc3c(cc21)CNC3.
What is the InChIKey of 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine?
The InChIKey is FIFXOLHDTMQDSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-3-19-11-12(5-4-6-17-2)15-7-13-9-18-10-14(13)8-16(15)19/h7-8,11,17-18H,3-6,9-10H2,1-2H3.
What are the key properties of 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine?
3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine has a molecular weight of 257.38 g/mol, XLogP of 2.42, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethyl-6,7-dihydro-5H-pyrrolo[3,4-f]indol-3-yl)-N-methylpropan-1-amine is sourced from PubChem (CID 83983697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).