N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine

C13H25N3O2 — CID 114657709

IUPACN-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine
SMILESCCCn1ncc(OC)c1C(NCC)C(C)OC
InChIInChI=1S/C13H25N3O2/c1-6-8-16-13(11(18-5)9-15-16)12(14-7-2)10(3)17-4/h9-10,12,14H,6-8H2,1-5H3
InChIKeyPDBBNFFQYPEUJP-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.99
Rot. Bonds8

About N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine

N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine (PubChem CID 114657709) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine
PubChem CID114657709
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine
SMILESCCCn1ncc(OC)c1C(NCC)C(C)OC
InChIInChI=1S/C13H25N3O2/c1-6-8-16-13(11(18-5)9-15-16)12(14-7-2)10(3)17-4/h9-10,12,14H,6-8H2,1-5H3
InChIKeyPDBBNFFQYPEUJP-UHFFFAOYSA-N
XLogP1.99
TPSA48.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-methoxy-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)propan-1-amine
CID 114657701
2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114644693
N-ethyl-1-(4-methoxy-1-propylpyrazol-5-yl)octan-1-amine
CID 105048951
[1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine
CID 105339861
3-(4-methoxy-1-propylpyrazol-5-yl)-N-propan-2-ylbutan-1-amine
CID 114666746
[1-(4-methoxy-1-propylpyrazol-5-yl)-3-methyl-2-propan-2-ylbutyl]hydrazine
CID 114282170
1-[1-[2-(dimethylamino)ethyl]-4-methoxypyrazol-5-yl]-N-ethyl-2-methylbutan-1-amine
CID 114651722
N-ethyl-1-(4-methoxy-1-propylpyrazol-5-yl)-3,3-dimethylbutan-1-amine
CID 114651925
1-(4-methoxy-1-propylpyrazol-5-yl)ethylhydrazine
CID 105201289
N-ethyl-1-(4-methoxy-1-propylpyrazol-5-yl)-2-propoxyethanamine
CID 114649130
N-ethyl-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methyl-3-methylsulfanylpropan-1-amine
CID 114222060
2-ethoxy-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-propylpropan-1-amine
CID 114652904

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine?
The IUPAC name of N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine (CID 114657709) is N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine?
The canonical SMILES for N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine is CCCn1ncc(OC)c1C(NCC)C(C)OC.
What is the InChIKey of N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine?
The InChIKey is PDBBNFFQYPEUJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-6-8-16-13(11(18-5)9-15-16)12(14-7-2)10(3)17-4/h9-10,12,14H,6-8H2,1-5H3.
What are the key properties of N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine?
N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine has a molecular weight of 255.36 g/mol, XLogP of 1.99, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine is sourced from PubChem (CID 114657709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).