3-ethenyl-6-prop-1-enyl-1H-inden-1-amine

C14H15N — CID 162275013

IUPAC3-ethenyl-6-prop-1-enyl-1H-inden-1-amine
SMILESC=CC1=CC(N)c2cc(C=CC)ccc21
InChIInChI=1S/C14H15N/c1-3-5-10-6-7-12-11(4-2)9-14(15)13(12)8-10/h3-9,14H,2,15H2,1H3
InChIKeyPWAFVWGZZZIXAF-UHFFFAOYSA-N
MW197.28 g/mol
LogP3.30
Rot. Bonds2

About 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine

3-ethenyl-6-prop-1-enyl-1H-inden-1-amine (PubChem CID 162275013) has the molecular formula C14H15N and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine.

Molecular Properties

Compound Name3-ethenyl-6-prop-1-enyl-1H-inden-1-amine
PubChem CID162275013
Molecular FormulaC14H15N
Molecular Weight197.28 g/mol
Exact Mass197.12
IUPAC Name3-ethenyl-6-prop-1-enyl-1H-inden-1-amine
SMILESC=CC1=CC(N)c2cc(C=CC)ccc21
InChIInChI=1S/C14H15N/c1-3-5-10-6-7-12-11(4-2)9-14(15)13(12)8-10/h3-9,14H,2,15H2,1H3
InChIKeyPWAFVWGZZZIXAF-UHFFFAOYSA-N
XLogP3.30
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine?
The IUPAC name of 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine (CID 162275013) is 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine.
What is the SMILES notation for 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine?
The canonical SMILES for 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine is C=CC1=CC(N)c2cc(C=CC)ccc21.
What is the InChIKey of 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine?
The InChIKey is PWAFVWGZZZIXAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N/c1-3-5-10-6-7-12-11(4-2)9-14(15)13(12)8-10/h3-9,14H,2,15H2,1H3.
What are the key properties of 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine?
3-ethenyl-6-prop-1-enyl-1H-inden-1-amine has a molecular weight of 197.28 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-6-prop-1-enyl-1H-inden-1-amine is sourced from PubChem (CID 162275013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).