2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide

C15H18N4O2 — CID 68854773

IUPAC2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide
SMILESCNC(=O)Cc1cc2c(ccc3cnn(CC(C)N)c32)o1
InChIInChI=1S/C15H18N4O2/c1-9(16)8-19-15-10(7-18-19)3-4-13-12(15)5-11(21-13)6-14(20)17-2/h3-5,7,9H,6,8,16H2,1-2H3,(H,17,20)
InChIKeyXVBRQHFCPQQYGO-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.42
Rot. Bonds4

About 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide

2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide (PubChem CID 68854773) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide.

Molecular Properties

Compound Name2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide
PubChem CID68854773
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide
SMILESCNC(=O)Cc1cc2c(ccc3cnn(CC(C)N)c32)o1
InChIInChI=1S/C15H18N4O2/c1-9(16)8-19-15-10(7-18-19)3-4-13-12(15)5-11(21-13)6-14(20)17-2/h3-5,7,9H,6,8,16H2,1-2H3,(H,17,20)
InChIKeyXVBRQHFCPQQYGO-UHFFFAOYSA-N
XLogP1.42
TPSA86.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide?
The IUPAC name of 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide (CID 68854773) is 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide.
What is the SMILES notation for 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide?
The canonical SMILES for 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide is CNC(=O)Cc1cc2c(ccc3cnn(CC(C)N)c32)o1.
What is the InChIKey of 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide?
The InChIKey is XVBRQHFCPQQYGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-9(16)8-19-15-10(7-18-19)3-4-13-12(15)5-11(21-13)6-14(20)17-2/h3-5,7,9H,6,8,16H2,1-2H3,(H,17,20).
What are the key properties of 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide?
2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide has a molecular weight of 286.34 g/mol, XLogP of 1.42, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-aminopropyl)furo[2,3-g]indazol-7-yl]-N-methylacetamide is sourced from PubChem (CID 68854773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).