N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine

C18H23NS — CID 65412104

IUPACN-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine
SMILESCCCNC(Cc1cccs1)C1Cc2ccccc2C1
InChIInChI=1S/C18H23NS/c1-2-9-19-18(13-17-8-5-10-20-17)16-11-14-6-3-4-7-15(14)12-16/h3-8,10,16,18-19H,2,9,11-13H2,1H3
InChIKeyOGEQSFIFXALSKD-UHFFFAOYSA-N
MW285.46 g/mol
LogP4.07
Rot. Bonds6

About N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine

N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine (PubChem CID 65412104) has the molecular formula C18H23NS and a molecular weight of 285.46 g/mol. Its IUPAC name is N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine.

Molecular Properties

Compound NameN-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine
PubChem CID65412104
Molecular FormulaC18H23NS
Molecular Weight285.46 g/mol
Exact Mass285.16
IUPAC NameN-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine
SMILESCCCNC(Cc1cccs1)C1Cc2ccccc2C1
InChIInChI=1S/C18H23NS/c1-2-9-19-18(13-17-8-5-10-20-17)16-11-14-6-3-4-7-15(14)12-16/h3-8,10,16,18-19H,2,9,11-13H2,1H3
InChIKeyOGEQSFIFXALSKD-UHFFFAOYSA-N
XLogP4.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.46
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]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

N-(1-cyclopentyl-2-thiophen-2-ylethyl)propan-1-amine
CID 61064990
N-(1-cyclohexyl-2-thiophen-2-ylethyl)propan-1-amine
CID 61066233
N-[1-(4-propan-2-ylcyclohexyl)-2-thiophen-2-ylethyl]propan-1-amine
CID 65424402
N-[1-(3-methylcyclopentyl)-2-thiophen-2-ylethyl]propan-1-amine
CID 65412770
N-[2-(3-bromothiophen-2-yl)-1-(2,3-dihydro-1H-inden-2-yl)ethyl]propan-1-amine
CID 65412289
1-(2,3-dihydro-1H-inden-2-yl)-4-methyl-N-propylpentan-1-amine
CID 65412290
N-[1-(3,4-dihydro-2H-chromen-3-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 79826944
1-cyclopentyl-N-ethyl-2-thiophen-2-ylethanamine
CID 61065338
N-[1-(2,3-dihydro-1H-inden-2-yl)-2-propan-2-yloxyethyl]propan-1-amine
CID 79574668
1-(2,3-dihydro-1H-inden-2-yl)-N-propylheptan-1-amine
CID 65412304
N-propyl-1-thiophen-2-ylpropan-2-amine
CID 43692824
1-(2,3-dihydro-1H-inden-2-yl)-5-methyl-N-propylhexan-1-amine
CID 83161369

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine?
The IUPAC name of N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine (CID 65412104) is N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine.
What is the SMILES notation for N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine?
The canonical SMILES for N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine is CCCNC(Cc1cccs1)C1Cc2ccccc2C1.
What is the InChIKey of N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine?
The InChIKey is OGEQSFIFXALSKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NS/c1-2-9-19-18(13-17-8-5-10-20-17)16-11-14-6-3-4-7-15(14)12-16/h3-8,10,16,18-19H,2,9,11-13H2,1H3.
What are the key properties of N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine?
N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine has a molecular weight of 285.46 g/mol, XLogP of 4.07, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,3-dihydro-1H-inden-2-yl)-2-thiophen-2-ylethyl]propan-1-amine is sourced from PubChem (CID 65412104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).