N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide

C15H15N3O2 — CID 57395333

IUPACN-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc(-c2nn(C)c3ccccc23)o1
InChIInChI=1S/C15H15N3O2/c1-10(19)16-9-11-7-8-14(20-11)15-12-5-3-4-6-13(12)18(2)17-15/h3-8H,9H2,1-2H3,(H,16,19)
InChIKeyDUUPEIZUPANWQV-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.47
Rot. Bonds3

About N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide

N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide (PubChem CID 57395333) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide
PubChem CID57395333
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide
SMILESCC(=O)NCc1ccc(-c2nn(C)c3ccccc23)o1
InChIInChI=1S/C15H15N3O2/c1-10(19)16-9-11-7-8-14(20-11)15-12-5-3-4-6-13(12)18(2)17-15/h3-8H,9H2,1-2H3,(H,16,19)
InChIKeyDUUPEIZUPANWQV-UHFFFAOYSA-N
XLogP2.47
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide?
The IUPAC name of N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide (CID 57395333) is N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide?
The canonical SMILES for N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide is CC(=O)NCc1ccc(-c2nn(C)c3ccccc23)o1.
What is the InChIKey of N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide?
The InChIKey is DUUPEIZUPANWQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-10(19)16-9-11-7-8-14(20-11)15-12-5-3-4-6-13(12)18(2)17-15/h3-8H,9H2,1-2H3,(H,16,19).
What are the key properties of N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide?
N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide has a molecular weight of 269.30 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(1-methylindazol-3-yl)furan-2-yl]methyl]acetamide is sourced from PubChem (CID 57395333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).