(2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine

C11H15N3O — CID 105146979

IUPAC(2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine
SMILESCCn1nc(C)cc1C(N)c1ccco1
InChIInChI=1S/C11H15N3O/c1-3-14-9(7-8(2)13-14)11(12)10-5-4-6-15-10/h4-7,11H,3,12H2,1-2H3
InChIKeyPIZCXIIZBOSEBH-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.85
Rot. Bonds3

About (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine

(2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine (PubChem CID 105146979) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine.

Molecular Properties

Compound Name(2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine
PubChem CID105146979
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name(2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine
SMILESCCn1nc(C)cc1C(N)c1ccco1
InChIInChI=1S/C11H15N3O/c1-3-14-9(7-8(2)13-14)11(12)10-5-4-6-15-10/h4-7,11H,3,12H2,1-2H3
InChIKeyPIZCXIIZBOSEBH-UHFFFAOYSA-N
XLogP1.85
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-ethyl-5-methylpyrazol-3-yl)-thiophen-2-ylmethanamine
CID 105100495
1-(2-ethyl-5-methylpyrazol-3-yl)-2-(furan-2-yl)ethanol
CID 105122915
(2-ethoxyphenyl)-(2-ethyl-5-methylpyrazol-3-yl)methanamine
CID 105145003
(2-ethyl-5-methylpyrazol-3-yl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 105176567
furan-2-yl-(2-methylpyrazol-3-yl)methanamine
CID 63962037
[(1E)-cycloocten-1-yl]-(2-ethyl-5-methylpyrazol-3-yl)methanamine
CID 106656773
cyclohepten-1-yl-(2-ethyl-5-methylpyrazol-3-yl)methanamine
CID 106657140
2-ethyl-N-(furan-2-ylmethyl)-5-methylpyrazol-3-amine
CID 122168955
2-(2,3-difluorophenyl)-1-(2-ethyl-5-methylpyrazol-3-yl)ethanamine
CID 105137759
2-(2,5-dimethylphenyl)-1-(2-ethyl-5-methylpyrazol-3-yl)ethanamine
CID 105101126
1-(2-ethyl-5-methylpyrazol-3-yl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 105188301
2-(3,4-dihydro-2H-chromen-4-yl)-1-(2-ethyl-5-methylpyrazol-3-yl)ethanamine
CID 105179822

Frequently Asked Questions

What is the IUPAC name of (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine?
The IUPAC name of (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine (CID 105146979) is (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine.
What is the SMILES notation for (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine?
The canonical SMILES for (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine is CCn1nc(C)cc1C(N)c1ccco1.
What is the InChIKey of (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine?
The InChIKey is PIZCXIIZBOSEBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-3-14-9(7-8(2)13-14)11(12)10-5-4-6-15-10/h4-7,11H,3,12H2,1-2H3.
What are the key properties of (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine?
(2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine has a molecular weight of 205.26 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethyl-5-methylpyrazol-3-yl)-(furan-2-yl)methanamine is sourced from PubChem (CID 105146979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).