(2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine

C15H21N3O2 — CID 105145725

IUPAC(2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine
SMILESCCc1cc(C(N)c2cc(OC)ccc2OC)n(C)n1
InChIInChI=1S/C15H21N3O2/c1-5-10-8-13(18(2)17-10)15(16)12-9-11(19-3)6-7-14(12)20-4/h6-9,15H,5,16H2,1-4H3
InChIKeyFFJXCLZVEWKCBF-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.05
Rot. Bonds5

About (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine

(2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine (PubChem CID 105145725) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine.

Molecular Properties

Compound Name(2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine
PubChem CID105145725
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name(2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine
SMILESCCc1cc(C(N)c2cc(OC)ccc2OC)n(C)n1
InChIInChI=1S/C15H21N3O2/c1-5-10-8-13(18(2)17-10)15(16)12-9-11(19-3)6-7-14(12)20-4/h6-9,15H,5,16H2,1-4H3
InChIKeyFFJXCLZVEWKCBF-UHFFFAOYSA-N
XLogP2.05
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(3-ethyl-1-methylpyrazol-5-yl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 105176507
1-(2,4-dimethoxyphenyl)-1-(3-ethyl-1-methylpyrazol-5-yl)-N-methylmethanamine
CID 105145074
(3-ethyl-1-methylpyrazol-5-yl)-(5-methoxy-3-pyridinyl)methanamine
CID 105175242
(3-ethyl-1-methylpyrazol-5-yl)-(4-methoxy-2-methylphenyl)methanol
CID 105083001
(1,3-diethylpyrazol-5-yl)-(2-fluoro-4-methoxyphenyl)methanamine
CID 103397297
(3-ethyl-1-methylpyrazol-5-yl)-[2-(trifluoromethyl)phenyl]methanamine
CID 105145412
(2,5-dimethoxyphenyl)-(5-ethyl-1,2,4-oxadiazol-3-yl)methanamine
CID 43559426
(2,5-dimethoxyphenyl)-(4-methoxyphenyl)methanamine
CID 43197203
[(3-ethyl-1-methylpyrazol-5-yl)-(3-methoxyphenyl)methyl]hydrazine
CID 105283558
1-(2,5-dimethoxyphenyl)butan-1-amine;hydrochloride
CID 86262898
(2,5-dimethoxyphenyl)-(2-ethoxyphenyl)methanamine
CID 43197204
(3-bromo-2,4-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanol
CID 103524545

Frequently Asked Questions

What is the IUPAC name of (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine?
The IUPAC name of (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine (CID 105145725) is (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine.
What is the SMILES notation for (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine?
The canonical SMILES for (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine is CCc1cc(C(N)c2cc(OC)ccc2OC)n(C)n1.
What is the InChIKey of (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine?
The InChIKey is FFJXCLZVEWKCBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-5-10-8-13(18(2)17-10)15(16)12-9-11(19-3)6-7-14(12)20-4/h6-9,15H,5,16H2,1-4H3.
What are the key properties of (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine?
(2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine has a molecular weight of 275.35 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dimethoxyphenyl)-(3-ethyl-1-methylpyrazol-5-yl)methanamine is sourced from PubChem (CID 105145725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).