N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide

C17H20N2O2 — CID 76896522

IUPACN-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide
SMILESCC(CCc1ccco1)NC(=O)C1Cc2ccccc2N1
InChIInChI=1S/C17H20N2O2/c1-12(8-9-14-6-4-10-21-14)18-17(20)16-11-13-5-2-3-7-15(13)19-16/h2-7,10,12,16,19H,8-9,11H2,1H3,(H,18,20)
InChIKeyLRNYZJSTXFAQMW-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.75
Rot. Bonds5

About N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide

N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 76896522) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID76896522
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide
SMILESCC(CCc1ccco1)NC(=O)C1Cc2ccccc2N1
InChIInChI=1S/C17H20N2O2/c1-12(8-9-14-6-4-10-21-14)18-17(20)16-11-13-5-2-3-7-15(13)19-16/h2-7,10,12,16,19H,8-9,11H2,1H3,(H,18,20)
InChIKeyLRNYZJSTXFAQMW-UHFFFAOYSA-N
XLogP2.75
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide (CID 76896522) is N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide is CC(CCc1ccco1)NC(=O)C1Cc2ccccc2N1.
What is the InChIKey of N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is LRNYZJSTXFAQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12(8-9-14-6-4-10-21-14)18-17(20)16-11-13-5-2-3-7-15(13)19-16/h2-7,10,12,16,19H,8-9,11H2,1H3,(H,18,20).
What are the key properties of N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide?
N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-2-yl)butan-2-yl]-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 76896522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).