(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine

C14H21N — CID 134490907

IUPAC(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine
SMILESCC[C@H]1Cc2ccccc2[C@@H]1NC(C)C
InChIInChI=1S/C14H21N/c1-4-11-9-12-7-5-6-8-13(12)14(11)15-10(2)3/h5-8,10-11,14-15H,4,9H2,1-3H3/t11-,14+/m0/s1
InChIKeyICHKGKJEHWSFII-SMDDNHRTSA-N
MW203.33 g/mol
LogP3.31
Rot. Bonds3

About (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine

(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine (PubChem CID 134490907) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine
PubChem CID134490907
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine
SMILESCC[C@H]1Cc2ccccc2[C@@H]1NC(C)C
InChIInChI=1S/C14H21N/c1-4-11-9-12-7-5-6-8-13(12)14(11)15-10(2)3/h5-8,10-11,14-15H,4,9H2,1-3H3/t11-,14+/m0/s1
InChIKeyICHKGKJEHWSFII-SMDDNHRTSA-N
XLogP3.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,2-N-di(propan-2-yl)-2,3-dihydro-1H-indene-1,2-diamine
CID 58384280
(1R,2R)-1-N,2-N-di(propan-2-yl)-2,3-dihydro-1H-indene-1,2-diamine
CID 58384358
(1R)-2-methoxy-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine
CID 166823758
N-propan-2-yl-2-propan-2-yloxy-2,3-dihydro-1H-inden-1-amine
CID 58384247
(1S,2R)-N-propan-2-yl-2-propan-2-yloxy-2,3-dihydro-1H-inden-1-amine
CID 58384530
5-bromo-3,6-diethyl-N-[(1S,2R)-2-ethyl-2,3-dihydro-1H-inden-1-yl]pyrazin-2-amine
CID 58631223
5-bromo-3,6-diethyl-N-[(1S,2S)-2-ethyl-2,3-dihydro-1H-inden-1-yl]pyrazin-2-amine
CID 58631224
1-[[(1R,2R)-2-ethyl-2,3-dihydro-1H-inden-1-yl]oxy]ethanol
CID 162738830
(1R,2R)-2-ethyl-N,N-dimethyl-2,3-dihydro-1H-inden-1-amine
CID 130469930
3-ethyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 89150261
(1R,2S)-1-(2-methylpropylamino)-2,3-dihydro-1H-inden-2-ol
CID 103880518
2-(2-methylpentyl)-2,3-dihydro-1H-inden-1-ol
CID 62264698

Frequently Asked Questions

What is the IUPAC name of (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine (CID 134490907) is (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine is CC[C@H]1Cc2ccccc2[C@@H]1NC(C)C.
What is the InChIKey of (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is ICHKGKJEHWSFII-SMDDNHRTSA-N. The full InChI is InChI=1S/C14H21N/c1-4-11-9-12-7-5-6-8-13(12)14(11)15-10(2)3/h5-8,10-11,14-15H,4,9H2,1-3H3/t11-,14+/m0/s1.
What are the key properties of (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine?
(1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,2S)-2-ethyl-N-propan-2-yl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 134490907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).