2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol

C15H20N2O — CID 82294420

IUPAC2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol
SMILESCc1[nH]c2ccccc2c1C(O)C(C)NC1CC1
InChIInChI=1S/C15H20N2O/c1-9-14(12-5-3-4-6-13(12)17-9)15(18)10(2)16-11-7-8-11/h3-6,10-11,15-18H,7-8H2,1-2H3
InChIKeyMOXHOECGNOZENF-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.65
Rot. Bonds4

About 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol

2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol (PubChem CID 82294420) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol
PubChem CID82294420
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol
SMILESCc1[nH]c2ccccc2c1C(O)C(C)NC1CC1
InChIInChI=1S/C15H20N2O/c1-9-14(12-5-3-4-6-13(12)17-9)15(18)10(2)16-11-7-8-11/h3-6,10-11,15-18H,7-8H2,1-2H3
InChIKeyMOXHOECGNOZENF-UHFFFAOYSA-N
XLogP2.65
TPSA48.05 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

Analyze 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol 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

1-(2-methyl-1H-indol-3-yl)propane-1,2,3-triol
CID 170819227
(2-methyl-1H-indol-3-yl)-piperidin-4-ylmethanol
CID 43146530
N'-cyclopropyl-N-methyl-1-(2-methyl-1H-indol-3-yl)ethane-1,2-diamine
CID 116950622
1-amino-1-(2-methyl-1H-indol-3-yl)propan-2-ol
CID 116859564
(2-methyl-1H-indol-3-yl)-pyrrolidin-2-ylmethanol
CID 64868312
2-(cyclopropylamino)-1-(2,3,5,6-tetramethylphenyl)propan-1-ol
CID 82296030
2-methyl-3-(1-piperidin-4-yloxyethyl)-1H-indole
CID 82300707
1-(2-methyl-1H-indol-3-yl)-2-sulfanylethanol
CID 116830002
N-ethyl-1-(2-methyl-1H-indol-3-yl)ethanamine
CID 65333195
(S)-(2-methyl-1H-indol-3-yl)-pyridin-2-ylmethanol
CID 696635
dimethyl 2-(2-methyl-1H-indol-3-yl)propanedioate
CID 10967266
(2S)-2-(cycloheptylamino)-1-phenylpropan-1-ol
CID 149151230

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol (CID 82294420) is 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol is Cc1[nH]c2ccccc2c1C(O)C(C)NC1CC1.
What is the InChIKey of 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol?
The InChIKey is MOXHOECGNOZENF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-9-14(12-5-3-4-6-13(12)17-9)15(18)10(2)16-11-7-8-11/h3-6,10-11,15-18H,7-8H2,1-2H3.
What are the key properties of 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol?
2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol has a molecular weight of 244.34 g/mol, XLogP of 2.65, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-1-(2-methyl-1H-indol-3-yl)propan-1-ol is sourced from PubChem (CID 82294420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).