2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine

C15H20N2 — CID 83918262

IUPAC2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine
SMILESCc1ccc2c(c1)c(C1CC1)c(CCN)n2C
InChIInChI=1S/C15H20N2/c1-10-3-6-13-12(9-10)15(11-4-5-11)14(7-8-16)17(13)2/h3,6,9,11H,4-5,7-8,16H2,1-2H3
InChIKeyDVRQNELIGZVUDC-UHFFFAOYSA-N
MW228.34 g/mol
LogP2.87
Rot. Bonds3

About 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine

2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine (PubChem CID 83918262) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine.

Molecular Properties

Compound Name2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine
PubChem CID83918262
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine
SMILESCc1ccc2c(c1)c(C1CC1)c(CCN)n2C
InChIInChI=1S/C15H20N2/c1-10-3-6-13-12(9-10)15(11-4-5-11)14(7-8-16)17(13)2/h3,6,9,11H,4-5,7-8,16H2,1-2H3
InChIKeyDVRQNELIGZVUDC-UHFFFAOYSA-N
XLogP2.87
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(5-chloro-3-cyclopropyl-1-methylindol-2-yl)methanamine
CID 83918924
3-cyclobutyl-1,5-dimethylindole-2-carbaldehyde
CID 83918158
6,9-dimethyl-1,2,3,4-tetrahydrocarbazol-4-amine
CID 84740019
N-[(3-bromo-1,5-dimethylindol-2-yl)methyl]cyclopropanamine
CID 84643930
2-(1,5-dimethylindol-3-yl)ethanamine;hydrochloride
CID 18933143
3-(3,6-dimethylcarbazol-9-yl)propan-1-amine
CID 58183726
N-methyl-2-(1,3,5-trimethylindol-2-yl)ethanamine
CID 84622406
4-(9-methyl-9,11-diazatetracyclo[9.2.2.02,10.03,8]pentadeca-2(10),3(8),4,6-tetraen-5-yl)butan-1-amine
CID 117455813
3-(2-aminoethyl)-N,N,5-trimethylindol-1-amine
CID 176928919
2-(3-bromo-1,5-dimethylindol-2-yl)-N-methylethanamine
CID 84642807
4-cyclopropyl-2-methyl-3-propylisoquinolin-1-one
CID 71531401
5-methyl-3-(1-methylpiperidin-4-yl)-2-methylsulfonylindol-1-amine
CID 174382438

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine?
The IUPAC name of 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine (CID 83918262) is 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine.
What is the SMILES notation for 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine?
The canonical SMILES for 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine is Cc1ccc2c(c1)c(C1CC1)c(CCN)n2C.
What is the InChIKey of 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine?
The InChIKey is DVRQNELIGZVUDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-10-3-6-13-12(9-10)15(11-4-5-11)14(7-8-16)17(13)2/h3,6,9,11H,4-5,7-8,16H2,1-2H3.
What are the key properties of 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine?
2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine has a molecular weight of 228.34 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-1,5-dimethylindol-2-yl)ethanamine is sourced from PubChem (CID 83918262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).