7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide

C18H19FN2O2 — CID 118708600

IUPAC7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide
SMILESCc1ccc(CN(C(=O)c2cc3cccc(F)c3[nH]2)C(C)C)o1
InChIInChI=1S/C18H19FN2O2/c1-11(2)21(10-14-8-7-12(3)23-14)18(22)16-9-13-5-4-6-15(19)17(13)20-16/h4-9,11,20H,10H2,1-3H3
InChIKeyCSKGNFWVQRRIAR-UHFFFAOYSA-N
MW314.36 g/mol
LogP4.26
Rot. Bonds4

About 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide

7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide (PubChem CID 118708600) has the molecular formula C18H19FN2O2 and a molecular weight of 314.36 g/mol. Its IUPAC name is 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide.

Molecular Properties

Compound Name7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide
PubChem CID118708600
Molecular FormulaC18H19FN2O2
Molecular Weight314.36 g/mol
Exact Mass314.14
IUPAC Name7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide
SMILESCc1ccc(CN(C(=O)c2cc3cccc(F)c3[nH]2)C(C)C)o1
InChIInChI=1S/C18H19FN2O2/c1-11(2)21(10-14-8-7-12(3)23-14)18(22)16-9-13-5-4-6-15(19)17(13)20-16/h4-9,11,20H,10H2,1-3H3
InChIKeyCSKGNFWVQRRIAR-UHFFFAOYSA-N
XLogP4.26
TPSA49.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.36
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide?
The IUPAC name of 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide (CID 118708600) is 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide.
What is the SMILES notation for 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide?
The canonical SMILES for 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide is Cc1ccc(CN(C(=O)c2cc3cccc(F)c3[nH]2)C(C)C)o1.
What is the InChIKey of 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide?
The InChIKey is CSKGNFWVQRRIAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O2/c1-11(2)21(10-14-8-7-12(3)23-14)18(22)16-9-13-5-4-6-15(19)17(13)20-16/h4-9,11,20H,10H2,1-3H3.
What are the key properties of 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide?
7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide has a molecular weight of 314.36 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N-[(5-methylfuran-2-yl)methyl]-N-propan-2-yl-1H-indole-2-carboxamide is sourced from PubChem (CID 118708600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).