2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine

C12H18N2 — CID 105444566

IUPAC2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine
SMILESCCNCC1Cc2cccc(N)c2C1
InChIInChI=1S/C12H18N2/c1-2-14-8-9-6-10-4-3-5-12(13)11(10)7-9/h3-5,9,14H,2,6-8,13H2,1H3
InChIKeyGPVDCNDEUXOCDM-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.59
Rot. Bonds3

About 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine

2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine (PubChem CID 105444566) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine.

Molecular Properties

Compound Name2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine
PubChem CID105444566
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine
SMILESCCNCC1Cc2cccc(N)c2C1
InChIInChI=1S/C12H18N2/c1-2-14-8-9-6-10-4-3-5-12(13)11(10)7-9/h3-5,9,14H,2,6-8,13H2,1H3
InChIKeyGPVDCNDEUXOCDM-UHFFFAOYSA-N
XLogP1.59
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-(4-amino-2,3-dihydro-1H-inden-2-yl)acetate
CID 105457459
ethyl 4-amino-2,3-dihydro-1H-indene-2-carboxylate
CID 131277883
7-[(cyclopropylamino)methyl]-5,6,7,8-tetrahydronaphthalen-1-amine
CID 105470440
5-bromo-3-(ethylaminomethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 71079504
6-(aminomethyl)-5,6,7,8-tetrahydronaphthalen-1-amine
CID 105436645
2-methoxy-2,3-dihydro-1H-inden-4-amine
CID 105432211
(2R,3R)-5-amino-3-methoxy-1,2,3,4-tetrahydronaphthalen-2-ol
CID 58734131
1-(2,3-dihydro-1H-inden-2-yl)-N-(furan-2-ylmethyl)methanamine
CID 103675715
4-amino-2,3-dihydro-1H-indene-2-carboxylic acid
CID 18330772
N-[(8-methyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]ethanamine
CID 105456793
1-(4-methoxy-2,3-dihydro-1H-inden-2-yl)-N-methylmethanamine
CID 105445390
5,6,7,8-tetrahydronaphthalene-1,6-diamine
CID 14836578

Frequently Asked Questions

What is the IUPAC name of 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine?
The IUPAC name of 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine (CID 105444566) is 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine.
What is the SMILES notation for 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine?
The canonical SMILES for 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine is CCNCC1Cc2cccc(N)c2C1.
What is the InChIKey of 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine?
The InChIKey is GPVDCNDEUXOCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-2-14-8-9-6-10-4-3-5-12(13)11(10)7-9/h3-5,9,14H,2,6-8,13H2,1H3.
What are the key properties of 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine?
2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine has a molecular weight of 190.29 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylaminomethyl)-2,3-dihydro-1H-inden-4-amine is sourced from PubChem (CID 105444566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).