N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine

C16H25NO2 — CID 115715426

IUPACN-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine
SMILESCOCCOCCCCNC1Cc2ccccc2C1
InChIInChI=1S/C16H25NO2/c1-18-10-11-19-9-5-4-8-17-16-12-14-6-2-3-7-15(14)13-16/h2-3,6-7,16-17H,4-5,8-13H2,1H3
InChIKeyHRDTZHZWCYKVRO-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.19
Rot. Bonds9

About N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine

N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 115715426) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine
PubChem CID115715426
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC NameN-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine
SMILESCOCCOCCCCNC1Cc2ccccc2C1
InChIInChI=1S/C16H25NO2/c1-18-10-11-19-9-5-4-8-17-16-12-14-6-2-3-7-15(14)13-16/h2-3,6-7,16-17H,4-5,8-13H2,1H3
InChIKeyHRDTZHZWCYKVRO-UHFFFAOYSA-N
XLogP2.19
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-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-[3-(2-methoxyethoxy)propyl]-2,3-dihydro-1H-inden-2-amine
CID 43512948
N-(3-ethoxypropyl)-2,3-dihydro-1H-inden-2-amine
CID 43512854
methyl 5-(2,3-dihydro-1H-inden-2-ylamino)pentanoate
CID 171725916
N-nonyl-2,3-dihydro-1H-inden-2-amine
CID 107851988
N-(3-butoxypropyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115572613
N-[4-(2-methoxyethoxy)butyl]-3,4-dihydro-1H-isothiochromen-4-amine
CID 115715459
3-(2,3-dihydro-1H-inden-2-ylamino)-N-(2-methoxyethyl)propanamide
CID 115711983
N-[3-(2-methoxyethoxy)propyl]-3-(2-methylphenyl)cyclobutan-1-amine
CID 43634729
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
6-bromo-N-(4-methoxybutyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 63627115
N-[3-(2-methoxyethoxy)propyl]-2,2-dimethyl-1,3-dihydroinden-1-amine
CID 82821247

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine (CID 115715426) is N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine is COCCOCCCCNC1Cc2ccccc2C1.
What is the InChIKey of N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is HRDTZHZWCYKVRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-18-10-11-19-9-5-4-8-17-16-12-14-6-2-3-7-15(14)13-16/h2-3,6-7,16-17H,4-5,8-13H2,1H3.
What are the key properties of N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine?
N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 263.38 g/mol, XLogP of 2.19, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methoxyethoxy)butyl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 115715426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).