N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine

C15H23NO2 — CID 43512948

IUPACN-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine
SMILESCOCCOCCCNC1Cc2ccccc2C1
InChIInChI=1S/C15H23NO2/c1-17-9-10-18-8-4-7-16-15-11-13-5-2-3-6-14(13)12-15/h2-3,5-6,15-16H,4,7-12H2,1H3
InChIKeyUCIKEARTANGKDV-UHFFFAOYSA-N
MW249.35 g/mol
LogP1.80
Rot. Bonds8

About N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine

N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 43512948) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine
PubChem CID43512948
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC NameN-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine
SMILESCOCCOCCCNC1Cc2ccccc2C1
InChIInChI=1S/C15H23NO2/c1-17-9-10-18-8-4-7-16-15-11-13-5-2-3-6-14(13)12-15/h2-3,5-6,15-16H,4,7-12H2,1H3
InChIKeyUCIKEARTANGKDV-UHFFFAOYSA-N
XLogP1.80
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine
CID 115715426
N-(3-ethoxypropyl)-2,3-dihydro-1H-inden-2-amine
CID 43512854
N-(3-butoxypropyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115572613
N-[3-(2-methoxyethoxy)propyl]-3-(2-methylphenyl)cyclobutan-1-amine
CID 43634729
methyl 5-(2,3-dihydro-1H-inden-2-ylamino)pentanoate
CID 171725916
3-(2,3-dihydro-1H-inden-2-ylamino)-N-(2-methoxyethyl)propanamide
CID 115711983
N-[3-(2-methoxyethoxy)propyl]-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 82821247
N-[3-(2-methoxyethoxy)propyl]-1-methylpiperidin-4-amine
CID 28720517
N-nonyl-2,3-dihydro-1H-inden-2-amine
CID 107851988
methyl 3-(2,3-dihydro-1H-inden-2-ylamino)propanoate
CID 24832867
3-(2,3-dihydro-1H-inden-2-ylamino)propan-1-ol
CID 3030975
N-[3-(2-methoxyethoxy)propyl]-3,5-dimethylcyclohexan-1-amine
CID 64724806

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine (CID 43512948) is N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine is COCCOCCCNC1Cc2ccccc2C1.
What is the InChIKey of N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is UCIKEARTANGKDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-17-9-10-18-8-4-7-16-15-11-13-5-2-3-6-14(13)12-15/h2-3,5-6,15-16H,4,7-12H2,1H3.
What are the key properties of N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine?
N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 249.35 g/mol, XLogP of 1.80, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 43512948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).