(2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine

C15H15N3O — CID 107330866

IUPAC(2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine
SMILESCc1occc1C(N)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H15N3O/c1-11-13(8-10-19-11)15(16)14-7-9-17-18(14)12-5-3-2-4-6-12/h2-10,15H,16H2,1H3
InChIKeyRRUCZUAYGVATQX-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.82
Rot. Bonds3

About (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine

(2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine (PubChem CID 107330866) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine.

Molecular Properties

Compound Name(2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine
PubChem CID107330866
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name(2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine
SMILESCc1occc1C(N)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H15N3O/c1-11-13(8-10-19-11)15(16)14-7-9-17-18(14)12-5-3-2-4-6-12/h2-10,15H,16H2,1H3
InChIKeyRRUCZUAYGVATQX-UHFFFAOYSA-N
XLogP2.82
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-methylphenyl)-(2-phenylpyrazol-3-yl)methanamine
CID 107330490
(2-ethylpyrazol-3-yl)-(2-methylfuran-3-yl)methanamine
CID 104789763
(5-methylfuran-2-yl)-(2-phenylpyrazol-3-yl)methanamine
CID 107332054
(3-methylphenyl)-(2-phenylpyrazol-3-yl)methanamine
CID 107330491
(5-methylthiophen-2-yl)-(2-phenylpyrazol-3-yl)methanamine
CID 107332136
(2,5-dibromophenyl)-(2-phenylpyrazol-3-yl)methanamine
CID 107332044
(6-methyl-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanamine
CID 107332063
(4-chloro-2-fluorophenyl)-(2-phenylpyrazol-3-yl)methanamine
CID 107330605
(5-ethylthiophen-2-yl)-(2-phenylpyrazol-3-yl)methanamine
CID 107331981
(3,5-difluorophenyl)-(2-phenylpyrazol-3-yl)methanamine
CID 107330561
2-(2-phenylpyrazol-3-yl)propan-1-amine
CID 105453704
(2-methylfuran-3-yl)-(4-phenylphenyl)methanamine
CID 43464106

Frequently Asked Questions

What is the IUPAC name of (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine?
The IUPAC name of (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine (CID 107330866) is (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine.
What is the SMILES notation for (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine?
The canonical SMILES for (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine is Cc1occc1C(N)c1ccnn1-c1ccccc1.
What is the InChIKey of (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine?
The InChIKey is RRUCZUAYGVATQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c1-11-13(8-10-19-11)15(16)14-7-9-17-18(14)12-5-3-2-4-6-12/h2-10,15H,16H2,1H3.
What are the key properties of (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine?
(2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine has a molecular weight of 253.31 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylfuran-3-yl)-(2-phenylpyrazol-3-yl)methanamine is sourced from PubChem (CID 107330866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).