1-propylidene-2,3-dihydroinden-5-amine

C12H15N — CID 79879504

IUPAC1-propylidene-2,3-dihydroinden-5-amine
SMILESCCC=C1CCc2cc(N)ccc21
InChIInChI=1S/C12H15N/c1-2-3-9-4-5-10-8-11(13)6-7-12(9)10/h3,6-8H,2,4-5,13H2,1H3
InChIKeyJVLUISAGNWDCDX-UHFFFAOYSA-N
MW173.26 g/mol
LogP3.01
Rot. Bonds1

About 1-propylidene-2,3-dihydroinden-5-amine

1-propylidene-2,3-dihydroinden-5-amine (PubChem CID 79879504) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 1-propylidene-2,3-dihydroinden-5-amine.

Molecular Properties

Compound Name1-propylidene-2,3-dihydroinden-5-amine
PubChem CID79879504
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name1-propylidene-2,3-dihydroinden-5-amine
SMILESCCC=C1CCc2cc(N)ccc21
InChIInChI=1S/C12H15N/c1-2-3-9-4-5-10-8-11(13)6-7-12(9)10/h3,6-8H,2,4-5,13H2,1H3
InChIKeyJVLUISAGNWDCDX-UHFFFAOYSA-N
XLogP3.01
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(2-methylsulfonylethylidene)-2,3-dihydroinden-5-amine
CID 79879919
(1Z)-1-(2-ethylbutylidene)-2,3-dihydroinden-5-amine
CID 82935712
1-[(3,5-dimethylphenyl)methylidene]-2,3-dihydroinden-5-amine
CID 79880127
ethane;(3E)-3-propylidene-1,2-dihydroindene
CID 143438466
1-prop-2-ynylidene-2,3-dihydroinden-5-amine
CID 79879291
5,6,12,13-tetrahydronaphtho[1,2-b]phenanthrene-3,10-diamine
CID 142820657
1-[(4-chloro-3-ethyl-1-methylpyrazol-5-yl)methylidene]-2,3-dihydroinden-5-amine
CID 79879614
1-[(2-methyl-1,2,4-triazol-3-yl)methylidene]-2,3-dihydroinden-5-amine
CID 79880555
(1Z)-1-(2-ethylcyclohexylidene)-2,3-dihydroinden-5-amine
CID 134081383
1-[(2-bromo-5-fluorophenyl)methylidene]-2,3-dihydroinden-5-amine
CID 79880125
bicyclo[4.2.0]octa-1(6),2,4-trien-3-amine
CID 11116040
1-(1-benzothiophen-3-ylmethylidene)-2,3-dihydroinden-5-amine
CID 79876412

Frequently Asked Questions

What is the IUPAC name of 1-propylidene-2,3-dihydroinden-5-amine?
The IUPAC name of 1-propylidene-2,3-dihydroinden-5-amine (CID 79879504) is 1-propylidene-2,3-dihydroinden-5-amine.
What is the SMILES notation for 1-propylidene-2,3-dihydroinden-5-amine?
The canonical SMILES for 1-propylidene-2,3-dihydroinden-5-amine is CCC=C1CCc2cc(N)ccc21.
What is the InChIKey of 1-propylidene-2,3-dihydroinden-5-amine?
The InChIKey is JVLUISAGNWDCDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-2-3-9-4-5-10-8-11(13)6-7-12(9)10/h3,6-8H,2,4-5,13H2,1H3.
What are the key properties of 1-propylidene-2,3-dihydroinden-5-amine?
1-propylidene-2,3-dihydroinden-5-amine has a molecular weight of 173.26 g/mol, XLogP of 3.01, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propylidene-2,3-dihydroinden-5-amine is sourced from PubChem (CID 79879504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).