1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine

C12H23N3O — CID 114664255

IUPAC1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine
SMILESCCC(CCc1c(OC)cnn1CC)NC
InChIInChI=1S/C12H23N3O/c1-5-10(13-3)7-8-11-12(16-4)9-14-15(11)6-2/h9-10,13H,5-8H2,1-4H3
InChIKeyXBVKZWNUYBLAKA-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.84
Rot. Bonds7

About 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine

1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine (PubChem CID 114664255) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine.

Molecular Properties

Compound Name1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine
PubChem CID114664255
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine
SMILESCCC(CCc1c(OC)cnn1CC)NC
InChIInChI=1S/C12H23N3O/c1-5-10(13-3)7-8-11-12(16-4)9-14-15(11)6-2/h9-10,13H,5-8H2,1-4H3
InChIKeyXBVKZWNUYBLAKA-UHFFFAOYSA-N
XLogP1.84
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-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

1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylhexan-3-amine
CID 114664174
2-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
CID 114662423
N-[(1-ethyl-4-methoxypyrazol-5-yl)methyl]propan-2-amine
CID 114652111
3-(1-ethyl-4-methoxypyrazol-5-yl)-N,2-dimethylpropan-1-amine
CID 114664456
2-(1-ethyl-4-methoxypyrazol-5-yl)-N-(2-methoxyethyl)ethanamine
CID 114662835
1-(4-chloro-1-methylpyrazol-5-yl)-N-methylpentan-3-amine
CID 114664248
1-(1-ethyl-4-methoxypyrazol-5-yl)-3-methoxy-N-methylpropan-1-amine
CID 114648521
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyldecan-1-amine
CID 105047878
2-ethoxy-1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylbutan-1-amine
CID 114661034
1-(4-methoxy-1-methylpyrazol-5-yl)pentan-3-amine
CID 114663864
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyl-2-methylsulfanylethanamine
CID 114649759
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyl-3-(4-methylphenyl)propan-1-amine
CID 105186575

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine?
The IUPAC name of 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine (CID 114664255) is 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine.
What is the SMILES notation for 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine?
The canonical SMILES for 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine is CCC(CCc1c(OC)cnn1CC)NC.
What is the InChIKey of 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine?
The InChIKey is XBVKZWNUYBLAKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-5-10(13-3)7-8-11-12(16-4)9-14-15(11)6-2/h9-10,13H,5-8H2,1-4H3.
What are the key properties of 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine?
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine has a molecular weight of 225.34 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methylpentan-3-amine is sourced from PubChem (CID 114664255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).