3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine

C12H23N3O — CID 114666702

IUPAC3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine
SMILESCCCn1ncc(OC)c1C(C)CCNC
InChIInChI=1S/C12H23N3O/c1-5-8-15-12(10(2)6-7-13-3)11(16-4)9-14-15/h9-10,13H,5-8H2,1-4H3
InChIKeyUXGWGHPQWJBQNE-UHFFFAOYSA-N
MW225.34 g/mol
LogP2.01
Rot. Bonds7

About 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine

3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine (PubChem CID 114666702) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine.

Molecular Properties

Compound Name3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine
PubChem CID114666702
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine
SMILESCCCn1ncc(OC)c1C(C)CCNC
InChIInChI=1S/C12H23N3O/c1-5-8-15-12(10(2)6-7-13-3)11(16-4)9-14-15/h9-10,13H,5-8H2,1-4H3
InChIKeyUXGWGHPQWJBQNE-UHFFFAOYSA-N
XLogP2.01
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 ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-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-(4-methoxy-1-propylpyrazol-5-yl)-N-propan-2-ylbutan-1-amine
CID 114666746
1-(4-methoxy-1-propylpyrazol-5-yl)ethylhydrazine
CID 105201289
1-(4-methoxy-1-propylpyrazol-5-yl)pentan-1-ol
CID 114635614
2-ethoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114643704
1-cyclopropyl-1-(4-methoxy-1-propylpyrazol-5-yl)-N-methylmethanamine
CID 114647967
2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-ol
CID 114644693
3-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine
CID 114648518
[1-(4-methoxy-1-propylpyrazol-5-yl)-3-methyl-2-propan-2-ylbutyl]hydrazine
CID 114282170
N-ethyl-2-methoxy-1-(4-methoxy-1-propylpyrazol-5-yl)propan-1-amine
CID 114657709
[1-(4-methoxy-1-propylpyrazol-5-yl)-2,3-dimethylbutyl]hydrazine
CID 105339861
3-[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-N-methylbutan-1-amine
CID 114666706
1-(4-methoxy-1-propylpyrazol-5-yl)-N-methyl-2-propoxyethanamine
CID 114649115

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine?
The IUPAC name of 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine (CID 114666702) is 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine.
What is the SMILES notation for 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine?
The canonical SMILES for 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine is CCCn1ncc(OC)c1C(C)CCNC.
What is the InChIKey of 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine?
The InChIKey is UXGWGHPQWJBQNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-5-8-15-12(10(2)6-7-13-3)11(16-4)9-14-15/h9-10,13H,5-8H2,1-4H3.
What are the key properties of 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine?
3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine has a molecular weight of 225.34 g/mol, XLogP of 2.01, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxy-1-propylpyrazol-5-yl)-N-methylbutan-1-amine is sourced from PubChem (CID 114666702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).