2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine

C10H19N3O — CID 79617281

IUPAC2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine
SMILESCCCn1cc(C(N)C(C)OC)cn1
InChIInChI=1S/C10H19N3O/c1-4-5-13-7-9(6-12-13)10(11)8(2)14-3/h6-8,10H,4-5,11H2,1-3H3
InChIKeyCXCLGVVFGYWIOI-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.33
Rot. Bonds5

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

2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine (PubChem CID 79617281) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine.

Molecular Properties

Compound Name2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine
PubChem CID79617281
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine
SMILESCCCn1cc(C(N)C(C)OC)cn1
InChIInChI=1S/C10H19N3O/c1-4-5-13-7-9(6-12-13)10(11)8(2)14-3/h6-8,10H,4-5,11H2,1-3H3
InChIKeyCXCLGVVFGYWIOI-UHFFFAOYSA-N
XLogP1.33
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-amino-2-(1-propylpyrazol-4-yl)acetate
CID 103572127
methanol;4-propan-2-yl-1-propylpyrazole
CID 164911743
4-butan-2-yl-1-propylpyrazole
CID 130194925
3-methoxy-3-methyl-1-(1-propylpyrazol-4-yl)butan-1-amine
CID 103024939
[2-methoxy-3-methyl-1-(1-propylpyrazol-4-yl)butyl]hydrazine
CID 105272039
1-(1-ethylpyrazol-4-yl)-2-methoxy-3-methylbutan-1-amine
CID 116719624
2-propan-2-ylsulfanyl-1-(1-propylpyrazol-4-yl)ethanamine
CID 65132226
2-amino-3-methyl-1-(1-propylpyrazol-4-yl)butan-1-ol
CID 103572279
2,2-dimethyl-1-(1-propylpyrazol-4-yl)butan-1-amine
CID 115807994
2-amino-2-(1-propylpyrazol-4-yl)acetamide
CID 103572056
(1-methoxycyclobutyl)-(1-propylpyrazol-4-yl)methanamine
CID 116714074
2-[(2-methylpropan-2-yl)oxy]-1-(1-propylpyrazol-4-yl)ethanamine
CID 105103681

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine?
The IUPAC name of 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine (CID 79617281) is 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine.
What is the SMILES notation for 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine?
The canonical SMILES for 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine is CCCn1cc(C(N)C(C)OC)cn1.
What is the InChIKey of 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine?
The InChIKey is CXCLGVVFGYWIOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-4-5-13-7-9(6-12-13)10(11)8(2)14-3/h6-8,10H,4-5,11H2,1-3H3.
What are the key properties of 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine?
2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine has a molecular weight of 197.28 g/mol, XLogP of 1.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-1-(1-propylpyrazol-4-yl)propan-1-amine is sourced from PubChem (CID 79617281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).