2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine

C17H25N — CID 65412477

IUPAC2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine
SMILESCNC(CC1CCCC1)C1Cc2ccccc2C1
InChIInChI=1S/C17H25N/c1-18-17(10-13-6-2-3-7-13)16-11-14-8-4-5-9-15(14)12-16/h4-5,8-9,13,16-18H,2-3,6-7,10-12H2,1H3
InChIKeyNSXAGNTUGYIZSA-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.57
Rot. Bonds4

About 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine

2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine (PubChem CID 65412477) has the molecular formula C17H25N and a molecular weight of 243.39 g/mol. Its IUPAC name is 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine.

Molecular Properties

Compound Name2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine
PubChem CID65412477
Molecular FormulaC17H25N
Molecular Weight243.39 g/mol
Exact Mass243.20
IUPAC Name2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine
SMILESCNC(CC1CCCC1)C1Cc2ccccc2C1
InChIInChI=1S/C17H25N/c1-18-17(10-13-6-2-3-7-13)16-11-14-8-4-5-9-15(14)12-16/h4-5,8-9,13,16-18H,2-3,6-7,10-12H2,1H3
InChIKeyNSXAGNTUGYIZSA-UHFFFAOYSA-N
XLogP3.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine?
The IUPAC name of 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine (CID 65412477) is 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine.
What is the SMILES notation for 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine?
The canonical SMILES for 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine is CNC(CC1CCCC1)C1Cc2ccccc2C1.
What is the InChIKey of 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine?
The InChIKey is NSXAGNTUGYIZSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N/c1-18-17(10-13-6-2-3-7-13)16-11-14-8-4-5-9-15(14)12-16/h4-5,8-9,13,16-18H,2-3,6-7,10-12H2,1H3.
What are the key properties of 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine?
2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine has a molecular weight of 243.39 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(2,3-dihydro-1H-inden-2-yl)-N-methylethanamine is sourced from PubChem (CID 65412477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).