1-methyl-5-propyl-2,3-dihydroindole

C12H17N — CID 89046240

IUPAC1-methyl-5-propyl-2,3-dihydroindole
SMILESCCCc1ccc2c(c1)CCN2C
InChIInChI=1S/C12H17N/c1-3-4-10-5-6-12-11(9-10)7-8-13(12)2/h5-6,9H,3-4,7-8H2,1-2H3
InChIKeyXQMGRSDSCRZVKN-UHFFFAOYSA-N
MW175.27 g/mol
LogP2.63
Rot. Bonds2

About 1-methyl-5-propyl-2,3-dihydroindole

1-methyl-5-propyl-2,3-dihydroindole (PubChem CID 89046240) has the molecular formula C12H17N and a molecular weight of 175.27 g/mol. Its IUPAC name is 1-methyl-5-propyl-2,3-dihydroindole.

Molecular Properties

Compound Name1-methyl-5-propyl-2,3-dihydroindole
PubChem CID89046240
Molecular FormulaC12H17N
Molecular Weight175.27 g/mol
Exact Mass175.14
IUPAC Name1-methyl-5-propyl-2,3-dihydroindole
SMILESCCCc1ccc2c(c1)CCN2C
InChIInChI=1S/C12H17N/c1-3-4-10-5-6-12-11(9-10)7-8-13(12)2/h5-6,9H,3-4,7-8H2,1-2H3
InChIKeyXQMGRSDSCRZVKN-UHFFFAOYSA-N
XLogP2.63
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.27
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-methyl-5-propyl-2,3-dihydroindole 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-methyl-2,3-dihydroindol-5-yl)propan-1-amine
CID 62095510
(1-methyl-2,3-dihydroindol-5-yl)-(4-propylphenyl)methanol
CID 63902192
2-methyl-N-[2-(1-methyl-2,3-dihydroindol-5-yl)ethyl]propan-2-amine
CID 64867066
N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butan-1-amine
CID 62096654
1-[2-(1-methyl-2,3-dihydroindol-5-yl)ethyl]cyclopropan-1-amine
CID 105470358
2,2-dimethyl-3-(1-methyl-2,3-dihydroindol-5-yl)propanenitrile
CID 116997085
N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]butan-2-amine
CID 62070504
2-methyl-N-[(1-methyl-2,3-dihydroindol-5-yl)methyl]pentan-2-amine
CID 113320268
N-(2-methoxyethyl)-2-(1-methyl-2,3-dihydroindol-5-yl)ethanamine
CID 64867290
1-methyl-5-(3-piperazin-1-ylpropyl)-2,3-dihydroindole
CID 116997078
N-ethyl-1-methyl-2,3-dihydroindol-5-amine
CID 82539913
N-methoxy-1-(1-methyl-2,3-dihydroindol-5-yl)methanamine
CID 82706033

Frequently Asked Questions

What is the IUPAC name of 1-methyl-5-propyl-2,3-dihydroindole?
The IUPAC name of 1-methyl-5-propyl-2,3-dihydroindole (CID 89046240) is 1-methyl-5-propyl-2,3-dihydroindole.
What is the SMILES notation for 1-methyl-5-propyl-2,3-dihydroindole?
The canonical SMILES for 1-methyl-5-propyl-2,3-dihydroindole is CCCc1ccc2c(c1)CCN2C.
What is the InChIKey of 1-methyl-5-propyl-2,3-dihydroindole?
The InChIKey is XQMGRSDSCRZVKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N/c1-3-4-10-5-6-12-11(9-10)7-8-13(12)2/h5-6,9H,3-4,7-8H2,1-2H3.
What are the key properties of 1-methyl-5-propyl-2,3-dihydroindole?
1-methyl-5-propyl-2,3-dihydroindole has a molecular weight of 175.27 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-propyl-2,3-dihydroindole is sourced from PubChem (CID 89046240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).