(1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine

C12H15N — CID 5326779

IUPAC(1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine
SMILESC=CCN[C@@H]1CCc2ccccc21
InChIInChI=1S/C12H15N/c1-2-9-13-12-8-7-10-5-3-4-6-11(10)12/h2-6,12-13H,1,7-9H2/t12-/m1/s1
InChIKeyRPAZWTZFMPXUKS-GFCCVEGCSA-N
MW173.26 g/mol
LogP2.45
Rot. Bonds3

About (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine

(1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 5326779) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name(1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine
PubChem CID5326779
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name(1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine
SMILESC=CCN[C@@H]1CCc2ccccc21
InChIInChI=1S/C12H15N/c1-2-9-13-12-8-7-10-5-3-4-6-11(10)12/h2-6,12-13H,1,7-9H2/t12-/m1/s1
InChIKeyRPAZWTZFMPXUKS-GFCCVEGCSA-N
XLogP2.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine (CID 5326779) is (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine is C=CCN[C@@H]1CCc2ccccc21.
What is the InChIKey of (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is RPAZWTZFMPXUKS-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H15N/c1-2-9-13-12-8-7-10-5-3-4-6-11(10)12/h2-6,12-13H,1,7-9H2/t12-/m1/s1.
What are the key properties of (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine?
(1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 173.26 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-prop-2-enyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 5326779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).