(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine

C13H19N — CID 130469930

IUPAC(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine
SMILESCC[C@@H]1Cc2ccccc2[C@@H]1N(C)C
InChIInChI=1S/C13H19N/c1-4-10-9-11-7-5-6-8-12(11)13(10)14(2)3/h5-8,10,13H,4,9H2,1-3H3/t10-,13-/m1/s1
InChIKeyWELRRAXGWFEVFI-ZWNOBZJWSA-N
MW189.30 g/mol
LogP2.87
Rot. Bonds2

About (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine

(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 130469930) has the molecular formula C13H19N and a molecular weight of 189.30 g/mol. Its IUPAC name is (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine
PubChem CID130469930
Molecular FormulaC13H19N
Molecular Weight189.30 g/mol
Exact Mass189.15
IUPAC Name(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine
SMILESCC[C@@H]1Cc2ccccc2[C@@H]1N(C)C
InChIInChI=1S/C13H19N/c1-4-10-9-11-7-5-6-8-12(11)13(10)14(2)3/h5-8,10,13H,4,9H2,1-3H3/t10-,13-/m1/s1
InChIKeyWELRRAXGWFEVFI-ZWNOBZJWSA-N
XLogP2.87
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,2R)-1-N,1-N-dimethyl-2,3-dihydro-1H-indene-1,2-diamine
CID 58717461
(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine
CID 134490907
N-methyl-N-[[(1S,2R)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]propan-1-amine
CID 125481800
3-ethyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 89150261
(3R)-2-ethyl-3-methyl-1,2,3,4-tetrahydronaphthalene
CID 163672179
1-[[(1R,2R)-2-ethyl-2,3-dihydro-1H-inden-1-yl]oxy]ethanol
CID 162738830
N-methyl-N-[[(1S,2S)-1-methyl-2,3-dihydro-1H-inden-2-yl]methyl]butan-1-amine
CID 125481673
(1S,2S)-1-ethyl-2,3-dihydro-1H-inden-2-ol
CID 130811012
2-(2-ethylbutyl)-2,3-dihydro-1H-inden-1-ol
CID 82930706
(1R,2R)-1-N,2-N,2-N-trimethyl-2,3-dihydro-1H-indene-1,2-diamine
CID 14327151
(1R)-1-propyl-2,3-dihydro-1H-inden-2-amine
CID 143271430
(1S)-1-ethyl-2,2-dimethyl-1,3-dihydroisoindol-2-ium
CID 139197809

Frequently Asked Questions

What is the IUPAC name of (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine (CID 130469930) is (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine is CC[C@@H]1Cc2ccccc2[C@@H]1N(C)C.
What is the InChIKey of (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is WELRRAXGWFEVFI-ZWNOBZJWSA-N. The full InChI is InChI=1S/C13H19N/c1-4-10-9-11-7-5-6-8-12(11)13(10)14(2)3/h5-8,10,13H,4,9H2,1-3H3/t10-,13-/m1/s1.
What are the key properties of (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine?
(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 189.30 g/mol, XLogP of 2.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 130469930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).