2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide

C15H17BrN4O2 — CID 91958679

IUPAC2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide
SMILESCCCn1nc(C)cc1NC(=O)c1cc2oc(Br)cc2n1C
InChIInChI=1S/C15H17BrN4O2/c1-4-5-20-14(6-9(2)18-20)17-15(21)11-7-12-10(19(11)3)8-13(16)22-12/h6-8H,4-5H2,1-3H3,(H,17,21)
InChIKeyGZYBENLWLPMPJL-UHFFFAOYSA-N
MW365.23 g/mol
LogP3.70
Rot. Bonds4

About 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide

2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide (PubChem CID 91958679) has the molecular formula C15H17BrN4O2 and a molecular weight of 365.23 g/mol. Its IUPAC name is 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide.

Molecular Properties

Compound Name2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide
PubChem CID91958679
Molecular FormulaC15H17BrN4O2
Molecular Weight365.23 g/mol
Exact Mass364.05
IUPAC Name2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide
SMILESCCCn1nc(C)cc1NC(=O)c1cc2oc(Br)cc2n1C
InChIInChI=1S/C15H17BrN4O2/c1-4-5-20-14(6-9(2)18-20)17-15(21)11-7-12-10(19(11)3)8-13(16)22-12/h6-8H,4-5H2,1-3H3,(H,17,21)
InChIKeyGZYBENLWLPMPJL-UHFFFAOYSA-N
XLogP3.70
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.23
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

CID 52013772
CID 52013772
CID 52013773
CID 52013773
CID 52013774
CID 52013774
CID 16674530
CID 16674530
CID 20884162
CID 20884162
CID 45492122
CID 45492122
CID 45492519
CID 45492519
CID 45494567
CID 45494567
CID 49653224
CID 49653224
CID 52005669
CID 52005669
CID 52005670
CID 52005670
CID 52005677
CID 52005677

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide?
The IUPAC name of 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide (CID 91958679) is 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide.
What is the SMILES notation for 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide?
The canonical SMILES for 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide is CCCn1nc(C)cc1NC(=O)c1cc2oc(Br)cc2n1C.
What is the InChIKey of 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide?
The InChIKey is GZYBENLWLPMPJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN4O2/c1-4-5-20-14(6-9(2)18-20)17-15(21)11-7-12-10(19(11)3)8-13(16)22-12/h6-8H,4-5H2,1-3H3,(H,17,21).
What are the key properties of 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide?
2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide has a molecular weight of 365.23 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-methyl-N-(5-methyl-2-propylpyrazol-3-yl)furo[3,2-b]pyrrole-5-carboxamide is sourced from PubChem (CID 91958679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).