1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine

C14H19N3 — CID 115809291

IUPAC1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
SMILESCCc1ccccc1C(NC)c1cnn(C)c1
InChIInChI=1S/C14H19N3/c1-4-11-7-5-6-8-13(11)14(15-2)12-9-16-17(3)10-12/h5-10,14-15H,4H2,1-3H3
InChIKeyWMBRYICYQLJLMA-UHFFFAOYSA-N
MW229.33 g/mol
LogP2.29
Rot. Bonds4

About 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine

1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine (PubChem CID 115809291) has the molecular formula C14H19N3 and a molecular weight of 229.33 g/mol. Its IUPAC name is 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine.

Molecular Properties

Compound Name1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
PubChem CID115809291
Molecular FormulaC14H19N3
Molecular Weight229.33 g/mol
Exact Mass229.16
IUPAC Name1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
SMILESCCc1ccccc1C(NC)c1cnn(C)c1
InChIInChI=1S/C14H19N3/c1-4-11-7-5-6-8-13(11)14(15-2)12-9-16-17(3)10-12/h5-10,14-15H,4H2,1-3H3
InChIKeyWMBRYICYQLJLMA-UHFFFAOYSA-N
XLogP2.29
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(1-methylpyrazol-4-yl)-1-naphthalen-1-ylmethanamine
CID 43485969
1-(2-tert-butylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 115809298
1-(2,3-dimethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 43485943
1-(2-ethylphenyl)-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine
CID 115822011
1-(2-ethylphenyl)-N-methyl-1-pyridin-3-ylmethanamine
CID 115799898
1-(4-cyclobutylphenyl)-1-(2-ethylphenyl)-N-methylmethanamine
CID 105045096
N-[(1-methylpyrazol-4-yl)-naphthalen-1-ylmethyl]ethanamine
CID 43492495
N-methyl-2-(2-methylphenyl)-1-(1-methylpyrazol-4-yl)ethanamine
CID 43485902
N-[(3-ethyl-2-pyridinyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine
CID 82740765
1-(2-methoxy-5-methylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 65195113
N-[(2-bromophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine
CID 43497333
1-(2-tert-butylphenyl)-N-methyl-1-(1-propylpyrazol-4-yl)methanamine
CID 115808315

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine?
The IUPAC name of 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine (CID 115809291) is 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine.
What is the SMILES notation for 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine?
The canonical SMILES for 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine is CCc1ccccc1C(NC)c1cnn(C)c1.
What is the InChIKey of 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine?
The InChIKey is WMBRYICYQLJLMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3/c1-4-11-7-5-6-8-13(11)14(15-2)12-9-16-17(3)10-12/h5-10,14-15H,4H2,1-3H3.
What are the key properties of 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine?
1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine has a molecular weight of 229.33 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylphenyl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine is sourced from PubChem (CID 115809291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).