2-(1H-indol-3-yl)propan-1-amine

C11H14N2 — CID 6452095

IUPAC2-(1H-indol-3-yl)propan-1-amine
SMILESCC(CN)c1c[nH]c2ccccc12
InChIInChI=1S/C11H14N2/c1-8(6-12)10-7-13-11-5-3-2-4-9(10)11/h2-5,7-8,13H,6,12H2,1H3
InChIKeyUNUICNBHOJTXMS-UHFFFAOYSA-N
MW174.25 g/mol
LogP2.23
Rot. Bonds2

About 2-(1H-indol-3-yl)propan-1-amine

2-(1H-indol-3-yl)propan-1-amine (PubChem CID 6452095) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)propan-1-amine.

Molecular Properties

Compound Name2-(1H-indol-3-yl)propan-1-amine
PubChem CID6452095
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name2-(1H-indol-3-yl)propan-1-amine
SMILESCC(CN)c1c[nH]c2ccccc12
InChIInChI=1S/C11H14N2/c1-8(6-12)10-7-13-11-5-3-2-4-9(10)11/h2-5,7-8,13H,6,12H2,1H3
InChIKeyUNUICNBHOJTXMS-UHFFFAOYSA-N
XLogP2.23
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 2-(1H-indol-3-yl)propan-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

2-(1H-indol-3-yl)propan-1-amine;hydrochloride
CID 11970278
(3R)-3-(1H-indol-3-yl)butan-1-ol
CID 93483686
3-propan-2-yl-1H-indole
CID 12534824
3-[(2S)-1-aminopropan-2-yl]-1H-indol-5-ol
CID 23928157
2-(1H-indol-3-yl)-2-phenylethanamine
CID 609935
2-(5-fluoro-1H-indol-3-yl)propan-1-amine
CID 13060
3-amino-1-(1H-indol-3-yl)propan-1-ol
CID 82281300
(1R)-1-(1H-indol-3-yl)-2-methylbutan-1-amine
CID 171197987
1-(1H-indol-3-yl)-N'-propan-2-ylethane-1,2-diamine
CID 116935052
2-(7-bromo-1H-indol-3-yl)propan-1-amine
CID 76846624
2-(1H-pyrrolo[3,2-b]pyridin-3-yl)propan-1-amine
CID 82653660
methyl 3-amino-2-(1H-indol-3-yl)propanoate
CID 11470824

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)propan-1-amine?
The IUPAC name of 2-(1H-indol-3-yl)propan-1-amine (CID 6452095) is 2-(1H-indol-3-yl)propan-1-amine.
What is the SMILES notation for 2-(1H-indol-3-yl)propan-1-amine?
The canonical SMILES for 2-(1H-indol-3-yl)propan-1-amine is CC(CN)c1c[nH]c2ccccc12.
What is the InChIKey of 2-(1H-indol-3-yl)propan-1-amine?
The InChIKey is UNUICNBHOJTXMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-8(6-12)10-7-13-11-5-3-2-4-9(10)11/h2-5,7-8,13H,6,12H2,1H3.
What are the key properties of 2-(1H-indol-3-yl)propan-1-amine?
2-(1H-indol-3-yl)propan-1-amine has a molecular weight of 174.25 g/mol, XLogP of 2.23, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)propan-1-amine is sourced from PubChem (CID 6452095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).