N-ethyl-9-prop-2-enylfluorene-9-carboxamide

C19H19NO — CID 22891395

IUPACN-ethyl-9-prop-2-enylfluorene-9-carboxamide
SMILESC=CCC1(C(=O)NCC)c2ccccc2-c2ccccc21
InChIInChI=1S/C19H19NO/c1-3-13-19(18(21)20-4-2)16-11-7-5-9-14(16)15-10-6-8-12-17(15)19/h3,5-12H,1,4,13H2,2H3,(H,20,21)
InChIKeyOLRCQLMZMRGGJR-UHFFFAOYSA-N
MW277.37 g/mol
LogP3.67
Rot. Bonds4

About N-ethyl-9-prop-2-enylfluorene-9-carboxamide

N-ethyl-9-prop-2-enylfluorene-9-carboxamide (PubChem CID 22891395) has the molecular formula C19H19NO and a molecular weight of 277.37 g/mol. Its IUPAC name is N-ethyl-9-prop-2-enylfluorene-9-carboxamide.

Molecular Properties

Compound NameN-ethyl-9-prop-2-enylfluorene-9-carboxamide
PubChem CID22891395
Molecular FormulaC19H19NO
Molecular Weight277.37 g/mol
Exact Mass277.15
IUPAC NameN-ethyl-9-prop-2-enylfluorene-9-carboxamide
SMILESC=CCC1(C(=O)NCC)c2ccccc2-c2ccccc21
InChIInChI=1S/C19H19NO/c1-3-13-19(18(21)20-4-2)16-11-7-5-9-14(16)15-10-6-8-12-17(15)19/h3,5-12H,1,4,13H2,2H3,(H,20,21)
InChIKeyOLRCQLMZMRGGJR-UHFFFAOYSA-N
XLogP3.67
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 53.67
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 N-ethyl-9-prop-2-enylfluorene-9-carboxamide?
The IUPAC name of N-ethyl-9-prop-2-enylfluorene-9-carboxamide (CID 22891395) is N-ethyl-9-prop-2-enylfluorene-9-carboxamide.
What is the SMILES notation for N-ethyl-9-prop-2-enylfluorene-9-carboxamide?
The canonical SMILES for N-ethyl-9-prop-2-enylfluorene-9-carboxamide is C=CCC1(C(=O)NCC)c2ccccc2-c2ccccc21.
What is the InChIKey of N-ethyl-9-prop-2-enylfluorene-9-carboxamide?
The InChIKey is OLRCQLMZMRGGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19NO/c1-3-13-19(18(21)20-4-2)16-11-7-5-9-14(16)15-10-6-8-12-17(15)19/h3,5-12H,1,4,13H2,2H3,(H,20,21).
What are the key properties of N-ethyl-9-prop-2-enylfluorene-9-carboxamide?
N-ethyl-9-prop-2-enylfluorene-9-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-9-prop-2-enylfluorene-9-carboxamide is sourced from PubChem (CID 22891395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).