1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine

C11H14N4O — CID 117216077

IUPAC1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine
SMILESCCn1nc(COc2cccnc2)cc1N
InChIInChI=1S/C11H14N4O/c1-2-15-11(12)6-9(14-15)8-16-10-4-3-5-13-7-10/h3-7H,2,8,12H2,1H3
InChIKeyCHYVFGOQXBAWKE-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.46
Rot. Bonds4

About 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine

1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine (PubChem CID 117216077) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine
PubChem CID117216077
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine
SMILESCCn1nc(COc2cccnc2)cc1N
InChIInChI=1S/C11H14N4O/c1-2-15-11(12)6-9(14-15)8-16-10-4-3-5-13-7-10/h3-7H,2,8,12H2,1H3
InChIKeyCHYVFGOQXBAWKE-UHFFFAOYSA-N
XLogP1.46
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-ethyl-3-[[3-(trifluoromethyl)phenoxy]methyl]pyrazol-5-amine
CID 117216049
1-ethyl-3-[[4-(trifluoromethyl)phenoxy]methyl]pyrazol-5-amine
CID 117216063
3-[(1-pentan-3-ylpyrazol-3-yl)methoxy]pyridine
CID 112558733
3-[(3-ethylphenoxy)methyl]-1-methylpyrazol-5-amine
CID 82082157
2-methyl-4-(pyridin-3-yloxymethyl)aniline
CID 117220552
5-chloro-2-(pyridin-3-yloxymethyl)imidazo[1,2-a]pyridine
CID 117255772
4-[[1-ethyl-5-(trifluoromethyl)pyrazol-3-yl]methoxy]pyridine
CID 154403788
3-octadecoxypyridine
CID 175800212
3-[(2,4,6-trimethylphenyl)methoxy]pyridine
CID 112558779
3-[(3-chlorophenoxy)methyl]-1-methylpyrazol-5-amine
CID 82083972
[2-methyl-5-(pyridin-3-yloxymethyl)furan-3-yl]methanamine
CID 62449563
3-[(4-methylphenyl)methoxy]pyridine
CID 58445986

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine?
The IUPAC name of 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine (CID 117216077) is 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine.
What is the SMILES notation for 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine?
The canonical SMILES for 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine is CCn1nc(COc2cccnc2)cc1N.
What is the InChIKey of 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine?
The InChIKey is CHYVFGOQXBAWKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-2-15-11(12)6-9(14-15)8-16-10-4-3-5-13-7-10/h3-7H,2,8,12H2,1H3.
What are the key properties of 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine?
1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine has a molecular weight of 218.26 g/mol, XLogP of 1.46, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(pyridin-3-yloxymethyl)pyrazol-5-amine is sourced from PubChem (CID 117216077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).