N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine

C13H20N2 — CID 117201839

IUPACN-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine
SMILESCNC(C)CC1CNc2ccc(C)cc21
InChIInChI=1S/C13H20N2/c1-9-4-5-13-12(6-9)11(8-15-13)7-10(2)14-3/h4-6,10-11,14-15H,7-8H2,1-3H3
InChIKeyVRCYFEBTRNDQLV-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.50
Rot. Bonds3

About N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine

N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine (PubChem CID 117201839) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine.

Molecular Properties

Compound NameN-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine
PubChem CID117201839
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine
SMILESCNC(C)CC1CNc2ccc(C)cc21
InChIInChI=1S/C13H20N2/c1-9-4-5-13-12(6-9)11(8-15-13)7-10(2)14-3/h4-6,10-11,14-15H,7-8H2,1-3H3
InChIKeyVRCYFEBTRNDQLV-UHFFFAOYSA-N
XLogP2.50
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-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

5-methyl-3-(2-methylpropyl)-2,3-dihydro-1H-indole
CID 106820143
N-methyl-1-[5-(trifluoromethyl)-2,3-dihydro-1H-indol-3-yl]propan-2-amine
CID 117201677
3-butyl-5-methyl-2,3-dihydro-1H-indole
CID 106820126
2-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-1-amine
CID 83860329
5-methoxy-3-(2-methylpropyl)-2,3-dihydro-1H-indole
CID 106986376
1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine
CID 117200409
3-heptan-2-yl-5-methyl-2,3-dihydro-1H-indole
CID 106820137
3-cyclopropyl-5-methyl-2,3-dihydro-1H-indole
CID 106985758
5-methyl-3-octan-2-yl-2,3-dihydro-1H-indole
CID 106820144
3-(5-bromo-2,3-dihydro-1H-indol-3-yl)-2-methylpropanoic acid
CID 117202166
1-(5-ethoxy-2,3-dihydro-1H-indol-3-yl)propan-2-amine
CID 82277205
1-(5-methyl-2,3-dihydro-1H-indol-3-yl)ethanone
CID 117201827

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine?
The IUPAC name of N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine (CID 117201839) is N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine.
What is the SMILES notation for N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine?
The canonical SMILES for N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine is CNC(C)CC1CNc2ccc(C)cc21.
What is the InChIKey of N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine?
The InChIKey is VRCYFEBTRNDQLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-9-4-5-13-12(6-9)11(8-15-13)7-10(2)14-3/h4-6,10-11,14-15H,7-8H2,1-3H3.
What are the key properties of N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine?
N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine has a molecular weight of 204.32 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine is sourced from PubChem (CID 117201839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).