2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine

C17H23N — CID 175263353

IUPAC2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine
SMILESC=CCc1ccccc1C(CN)(CC=C)CC=C
InChIInChI=1S/C17H23N/c1-4-9-15-10-7-8-11-16(15)17(14-18,12-5-2)13-6-3/h4-8,10-11H,1-3,9,12-14,18H2
InChIKeyUFKXNMDNRIOLPK-UHFFFAOYSA-N
MW241.38 g/mol
LogP3.76
Rot. Bonds8

About 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine

2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine (PubChem CID 175263353) has the molecular formula C17H23N and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine.

Molecular Properties

Compound Name2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine
PubChem CID175263353
Molecular FormulaC17H23N
Molecular Weight241.38 g/mol
Exact Mass241.18
IUPAC Name2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine
SMILESC=CCc1ccccc1C(CN)(CC=C)CC=C
InChIInChI=1S/C17H23N/c1-4-9-15-10-7-8-11-16(15)17(14-18,12-5-2)13-6-3/h4-8,10-11H,1-3,9,12-14,18H2
InChIKeyUFKXNMDNRIOLPK-UHFFFAOYSA-N
XLogP3.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 53.76
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 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine?
The IUPAC name of 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine (CID 175263353) is 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine.
What is the SMILES notation for 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine?
The canonical SMILES for 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine is C=CCc1ccccc1C(CN)(CC=C)CC=C.
What is the InChIKey of 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine?
The InChIKey is UFKXNMDNRIOLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N/c1-4-9-15-10-7-8-11-16(15)17(14-18,12-5-2)13-6-3/h4-8,10-11H,1-3,9,12-14,18H2.
What are the key properties of 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine?
2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine has a molecular weight of 241.38 g/mol, XLogP of 3.76, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enyl-2-(2-prop-2-enylphenyl)pent-4-en-1-amine is sourced from PubChem (CID 175263353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).