1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine

C13H21N5O — CID 105186620

IUPAC1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine
SMILESCCn1ncc(OC)c1C(NC)c1cnn(C)c1C
InChIInChI=1S/C13H21N5O/c1-6-18-13(11(19-5)8-16-18)12(14-3)10-7-15-17(4)9(10)2/h7-8,12,14H,6H2,1-5H3
InChIKeyIQCMIFXWQLNYJR-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.26
Rot. Bonds5

About 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine

1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine (PubChem CID 105186620) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine
PubChem CID105186620
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC Name1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine
SMILESCCn1ncc(OC)c1C(NC)c1cnn(C)c1C
InChIInChI=1S/C13H21N5O/c1-6-18-13(11(19-5)8-16-18)12(14-3)10-7-15-17(4)9(10)2/h7-8,12,14H,6H2,1-5H3
InChIKeyIQCMIFXWQLNYJR-UHFFFAOYSA-N
XLogP1.26
TPSA56.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-bromo-5-methylphenyl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine
CID 105047758
1-(5-chloro-2-methoxyphenyl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine
CID 105047783
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyl-1-pyrazolo[1,5-a]pyrazin-3-ylmethanamine
CID 103128278
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyl-1-(5-methylpyrazin-2-yl)methanamine
CID 105186619
1-(1-ethyl-4-methoxypyrazol-5-yl)-1-(3-ethyl-4-pyridinyl)-N-methylmethanamine
CID 114659908
1-(5-bromo-2-chlorophenyl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine
CID 105048031
1-(4-bromo-1-propylpyrazol-5-yl)-1-(1,5-dimethylpyrazol-4-yl)-N-methylmethanamine
CID 105183464
(1,5-dimethylpyrazol-4-yl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114636784
1-(4-fluoro-2-methylphenyl)-1-(4-methoxy-1-propylpyrazol-5-yl)-N-methylmethanamine
CID 114659071
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyl-1-(4-propan-2-ylthiadiazol-5-yl)methanamine
CID 105186690
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyl-2-methylsulfanylethanamine
CID 114649759
1-(2-methoxy-5-methylphenyl)-1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylmethanamine
CID 105047026

Frequently Asked Questions

What is the IUPAC name of 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine (CID 105186620) is 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine is CCn1ncc(OC)c1C(NC)c1cnn(C)c1C.
What is the InChIKey of 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine?
The InChIKey is IQCMIFXWQLNYJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-6-18-13(11(19-5)8-16-18)12(14-3)10-7-15-17(4)9(10)2/h7-8,12,14H,6H2,1-5H3.
What are the key properties of 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine?
1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine has a molecular weight of 263.34 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,5-dimethylpyrazol-4-yl)-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylmethanamine is sourced from PubChem (CID 105186620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).