1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine

C10H19N3O2 — CID 66013084

IUPAC1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine
SMILESCCn1nc(C)c(N)c1OCCCOC
InChIInChI=1S/C10H19N3O2/c1-4-13-10(9(11)8(2)12-13)15-7-5-6-14-3/h4-7,11H2,1-3H3
InChIKeyMSMOJKMCHIXVMP-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.21
Rot. Bonds6

About 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine

1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine (PubChem CID 66013084) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine.

Molecular Properties

Compound Name1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine
PubChem CID66013084
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine
SMILESCCn1nc(C)c(N)c1OCCCOC
InChIInChI=1S/C10H19N3O2/c1-4-13-10(9(11)8(2)12-13)15-7-5-6-14-3/h4-7,11H2,1-3H3
InChIKeyMSMOJKMCHIXVMP-UHFFFAOYSA-N
XLogP1.21
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-5-[2-(2-methoxyethoxy)ethoxy]-3-methylpyrazol-4-amine
CID 104559959
5-(2-butoxyethoxy)-1-ethyl-3-methylpyrazol-4-amine
CID 66013671
1-ethyl-3-methyl-5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]pyrazol-4-amine
CID 112587047
5-[2-[di(propan-2-yl)amino]ethoxy]-1-ethyl-3-methylpyrazol-4-amine
CID 115505356
5-[3-(2-methoxyethoxy)propoxy]-1,3-dimethylpyrazol-4-amine
CID 103400910
1-ethyl-5-[(3-methoxyphenyl)methoxy]-3-methylpyrazol-4-amine
CID 66012494
4-amino-1-ethyl-N-(4-methoxybutyl)-3-methylpyrazole-5-carboxamide
CID 66123504
5-(2,6-dimethoxyphenoxy)-1-ethyl-3-methylpyrazol-4-amine
CID 66013664
5-hexoxy-1,3-dimethylpyrazol-4-amine
CID 43554474
1-ethyl-5-[3-(methoxymethyl)phenoxy]-3-methylpyrazol-4-amine
CID 66012305
1-ethyl-3-methyl-5-pentan-2-yloxypyrazol-4-amine
CID 102980348
5-(3,4-difluorophenoxy)-1-ethyl-3-methylpyrazol-4-amine
CID 66012495

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine?
The IUPAC name of 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine (CID 66013084) is 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine.
What is the SMILES notation for 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine?
The canonical SMILES for 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine is CCn1nc(C)c(N)c1OCCCOC.
What is the InChIKey of 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine?
The InChIKey is MSMOJKMCHIXVMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c1-4-13-10(9(11)8(2)12-13)15-7-5-6-14-3/h4-7,11H2,1-3H3.
What are the key properties of 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine?
1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine has a molecular weight of 213.28 g/mol, XLogP of 1.21, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-5-(3-methoxypropoxy)-3-methylpyrazol-4-amine is sourced from PubChem (CID 66013084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).