N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide

C15H13N5O3 — CID 56864815

IUPACN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide
SMILESCn1ccn2ncc(C(=O)NCc3cc(-c4ccco4)on3)c12
InChIInChI=1S/C15H13N5O3/c1-19-4-5-20-15(19)11(9-17-20)14(21)16-8-10-7-13(23-18-10)12-3-2-6-22-12/h2-7,9H,8H2,1H3,(H,16,21)
InChIKeyZKYZSJUOGUXBEG-UHFFFAOYSA-N
MW311.30 g/mol
LogP1.85
Rot. Bonds4

About N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide

N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide (PubChem CID 56864815) has the molecular formula C15H13N5O3 and a molecular weight of 311.30 g/mol. Its IUPAC name is N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide.

Molecular Properties

Compound NameN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide
PubChem CID56864815
Molecular FormulaC15H13N5O3
Molecular Weight311.30 g/mol
Exact Mass311.10
IUPAC NameN-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide
SMILESCn1ccn2ncc(C(=O)NCc3cc(-c4ccco4)on3)c12
InChIInChI=1S/C15H13N5O3/c1-19-4-5-20-15(19)11(9-17-20)14(21)16-8-10-7-13(23-18-10)12-3-2-6-22-12/h2-7,9H,8H2,1H3,(H,16,21)
InChIKeyZKYZSJUOGUXBEG-UHFFFAOYSA-N
XLogP1.85
TPSA90.50 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.30
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-Furan-2yl-isoxazole-3-carboxylic acid (3-imidazol-1yl-propyl)-amide
CID 16003447
N-(4-amino-1-propan-2-ylpyrazolo[3,4-d]pyrimidin-3-yl)-5-(furan-2-yl)-1,2-oxazole-3-carboxamide
CID 137652296
2-(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)-N-{[5-(2-furyl)isoxazol-3-yl]methyl}acetamide
CID 56877044
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-2-[4-[4-methyl-6-[[4-(trifluoromethyl)pyridin-2-yl]amino]pyridin-2-yl]triazol-1-yl]propanamide
CID 118324412
N-(3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl)phenyl)-5-(furan-2-yl)isoxazole-3-carboxamide
CID 71797927
5-(furan-2-yl)-N-(3-(2-phenyl-1H-imidazol-1-yl)propyl)isoxazole-3-carboxamide
CID 24740092
5-(furan-2-yl)-N-((8-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl)methyl)isoxazole-3-carboxamide
CID 91632820
N-(3-(1H-imidazol-1-yl)propyl)-2-(5-(furan-2-yl)isoxazol-3-yl)acetamide
CID 44044922
N-{[5-(2-furyl)isoxazol-3-yl]methyl}-6-methyl-2-pyridin-3-ylpyrimidin-4-amine
CID 50985542
N-{[5-(2-furyl)isoxazol-3-yl]methyl}-2-methylimidazo[1,2-a]pyrimidine-3-carboxamide
CID 56757774
N-{[5-(2-furyl)isoxazol-3-yl]methyl}-2-(8-methylimidazo[1,2-a]pyridin-3-yl)acetamide
CID 56871336
N-(3-(1H-pyrrolo[2,3-b]pyridin-1-yl)propyl)-5-(furan-2-yl)isoxazole-3-carboxamide
CID 76146918

Frequently Asked Questions

What is the IUPAC name of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide?
The IUPAC name of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide (CID 56864815) is N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide.
What is the SMILES notation for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide?
The canonical SMILES for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide is Cn1ccn2ncc(C(=O)NCc3cc(-c4ccco4)on3)c12.
What is the InChIKey of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide?
The InChIKey is ZKYZSJUOGUXBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O3/c1-19-4-5-20-15(19)11(9-17-20)14(21)16-8-10-7-13(23-18-10)12-3-2-6-22-12/h2-7,9H,8H2,1H3,(H,16,21).
What are the key properties of N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide?
N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide has a molecular weight of 311.30 g/mol, XLogP of 1.85, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide is sourced from PubChem (CID 56864815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).