4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine

C12H23N3O — CID 103028808

IUPAC4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine
SMILESCNC(Cc1ccn(C)n1)CC(C)(C)OC
InChIInChI=1S/C12H23N3O/c1-12(2,16-5)9-11(13-3)8-10-6-7-15(4)14-10/h6-7,11,13H,8-9H2,1-5H3
InChIKeyVRNPOUVGRQUNCJ-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.37
Rot. Bonds6

About 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine

4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine (PubChem CID 103028808) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine.

Molecular Properties

Compound Name4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine
PubChem CID103028808
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC Name4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine
SMILESCNC(Cc1ccn(C)n1)CC(C)(C)OC
InChIInChI=1S/C12H23N3O/c1-12(2,16-5)9-11(13-3)8-10-6-7-15(4)14-10/h6-7,11,13H,8-9H2,1-5H3
InChIKeyVRNPOUVGRQUNCJ-UHFFFAOYSA-N
XLogP1.37
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-Methoxy-3-methyl-1-(2-propylpyrazol-3-yl)butyl]hydrazine
CID 103025317
[1-(2-Ethylpyrazol-3-yl)-3-methoxy-3-methylbutyl]hydrazine
CID 103025318
[3-Methoxy-3-methyl-1-(2-methylpyrazol-3-yl)butyl]hydrazine
CID 103025319
[1-(1-Cyclohexylpyrazol-3-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 103025341
[1-(2,5-Dimethylpyrazol-3-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 103025366
[1-(3-Ethyl-1-methylpyrazol-5-yl)-4-methoxy-4-methylpentan-2-yl]hydrazine
CID 103025374
[4-Methoxy-4-methyl-1-(1-methylpyrazol-3-yl)pentan-2-yl]hydrazine
CID 103025446
[1-Methoxy-5-(2-methylpyrazol-3-yl)pentan-3-yl]hydrazine
CID 103026034
[1-(2-Methylpyrazol-3-yl)-5-propoxypentan-3-yl]hydrazine
CID 103026039
[1-(2-Methyloxolan-2-yl)-3-(2-methylpyrazol-3-yl)propyl]hydrazine
CID 103026043
[6-Methoxy-1-(2-methylpyrazol-3-yl)hexan-3-yl]hydrazine
CID 103026068
[4-(2-Methylpyrazol-3-yl)-1-(oxan-2-yl)butan-2-yl]hydrazine
CID 103026075

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine?
The IUPAC name of 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine (CID 103028808) is 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine.
What is the SMILES notation for 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine?
The canonical SMILES for 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine is CNC(Cc1ccn(C)n1)CC(C)(C)OC.
What is the InChIKey of 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine?
The InChIKey is VRNPOUVGRQUNCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-12(2,16-5)9-11(13-3)8-10-6-7-15(4)14-10/h6-7,11,13H,8-9H2,1-5H3.
What are the key properties of 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine?
4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine has a molecular weight of 225.34 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,4-dimethyl-1-(1-methylpyrazol-3-yl)pentan-2-amine is sourced from PubChem (CID 103028808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).