N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide

C15H19N3O2 — CID 71808548

IUPACN-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)NCc2cc(C3CC3)n(C)n2)c(C)o1
InChIInChI=1S/C15H19N3O2/c1-9-6-13(10(2)20-9)15(19)16-8-12-7-14(11-4-5-11)18(3)17-12/h6-7,11H,4-5,8H2,1-3H3,(H,16,19)
InChIKeyJRWOVVUFBZPHGY-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.44
Rot. Bonds4

About N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide

N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide (PubChem CID 71808548) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide
PubChem CID71808548
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)NCc2cc(C3CC3)n(C)n2)c(C)o1
InChIInChI=1S/C15H19N3O2/c1-9-6-13(10(2)20-9)15(19)16-8-12-7-14(11-4-5-11)18(3)17-12/h6-7,11H,4-5,8H2,1-3H3,(H,16,19)
InChIKeyJRWOVVUFBZPHGY-UHFFFAOYSA-N
XLogP2.44
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-[(E)-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylidene]-2-methylfuran-3-carbohydrazide
CID 6885163
Furan-3-carbohydrazide, 2-methyl-N2-(3,5-dimethyl-1-pentylpyrazol-4-yl)methylene-
CID 9593094
N-cyclopropyl-2-{1-[(5-methyl-2-furyl)methyl]-3-oxopiperazin-2-yl}-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]acetamide
CID 16188732
1-(2,5-dimethyl-3-furoyl)-N-[4-(3,5-dimethyl-1H-pyrazol-1-yl)phenyl]-2-piperidinecarboxamide
CID 24791263
N-[(Z)-(3,5-dimethyl-1-pentylpyrazol-4-yl)methylideneamino]-2,5-dimethylfuran-3-carboxamide
CID 5976730
N'-[(E)-(3,5-dimethyl-1-phenyl-1H-pyrazol-4-yl)methylidene]-2,5-dimethylfuran-3-carbohydrazide
CID 6861731
(3,5-Dimethylpyrazol-1-yl)-(2-methylfuran-3-yl)methanone
CID 695657
1,5-dimethyl-N-[[5-methyl-2-(trifluoromethyl)furan-3-yl]methyl]pyrazole-3-carboxamide
CID 2738491
N-(2,5-dimethylpyrazol-3-yl)-2,5-dimethylfuran-3-carboxamide
CID 2811734
N-[3-(3,5-dimethylpyrazol-1-yl)-2-methylpropyl]-3-(furan-2-yl)propanamide
CID 45827686
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-2,4,5-trimethylfuran-3-carboxamide
CID 45857117
1-(2,5-dimethyl-3-furoyl)-4-[2-(1H-pyrazol-1-yl)ethyl]piperidine
CID 70735289

Frequently Asked Questions

What is the IUPAC name of N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide (CID 71808548) is N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide is Cc1cc(C(=O)NCc2cc(C3CC3)n(C)n2)c(C)o1.
What is the InChIKey of N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide?
The InChIKey is JRWOVVUFBZPHGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-9-6-13(10(2)20-9)15(19)16-8-12-7-14(11-4-5-11)18(3)17-12/h6-7,11H,4-5,8H2,1-3H3,(H,16,19).
What are the key properties of N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide?
N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 71808548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).