3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine

C15H29N3O — CID 116716994

IUPAC3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine
SMILESCCNC(Cc1ccn(C(C)C)n1)C(CC)OCC
InChIInChI=1S/C15H29N3O/c1-6-15(19-8-3)14(16-7-2)11-13-9-10-18(17-13)12(4)5/h9-10,12,14-16H,6-8,11H2,1-5H3
InChIKeyIASYRJOBRNOHMH-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.80
Rot. Bonds9

About 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine

3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine (PubChem CID 116716994) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine.

Molecular Properties

Compound Name3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine
PubChem CID116716994
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC Name3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine
SMILESCCNC(Cc1ccn(C(C)C)n1)C(CC)OCC
InChIInChI=1S/C15H29N3O/c1-6-15(19-8-3)14(16-7-2)11-13-9-10-18(17-13)12(4)5/h9-10,12,14-16H,6-8,11H2,1-5H3
InChIKeyIASYRJOBRNOHMH-UHFFFAOYSA-N
XLogP2.80
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-ethoxy-N-ethyl-4-methyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine
CID 116721524
1-(1-butan-2-ylpyrazol-3-yl)-3-ethoxy-N-ethylhexan-2-amine
CID 116718183
1-(1-butan-2-ylpyrazol-3-yl)-N-ethyl-3-methoxypentan-2-amine
CID 116715887
[3-ethoxy-1-(1-pentan-3-ylpyrazol-3-yl)pentan-2-yl]hydrazine
CID 105271202
N-ethyl-4-methyl-3-[(1-propan-2-ylpyrazol-3-yl)methyl]pentan-2-amine
CID 64771858
3-ethoxy-1-(1-pentan-3-ylpyrazol-3-yl)-N-propylbutan-2-amine
CID 64779415
1-(2,6-dimethyl-4-pyridinyl)-N-ethyl-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 107503911
3-methoxy-1-(1-pentan-3-ylpyrazol-3-yl)-N-propylpentan-2-amine
CID 116716177
N-ethyl-1-(2-iodophenyl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 104990155
N-ethyl-1-(3-methylimidazol-4-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 82902628
3-methoxy-4-methyl-1-(1-propan-2-ylpyrazol-3-yl)-N-propylpentan-2-amine
CID 116720670
[3-methoxy-1-(1-propan-2-ylpyrazol-3-yl)hexan-2-yl]hydrazine
CID 105271606

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine?
The IUPAC name of 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine (CID 116716994) is 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine.
What is the SMILES notation for 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine?
The canonical SMILES for 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine is CCNC(Cc1ccn(C(C)C)n1)C(CC)OCC.
What is the InChIKey of 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine?
The InChIKey is IASYRJOBRNOHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-6-15(19-8-3)14(16-7-2)11-13-9-10-18(17-13)12(4)5/h9-10,12,14-16H,6-8,11H2,1-5H3.
What are the key properties of 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine?
3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine has a molecular weight of 267.42 g/mol, XLogP of 2.80, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-ethyl-1-(1-propan-2-ylpyrazol-3-yl)pentan-2-amine is sourced from PubChem (CID 116716994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).