1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine

C11H21N3O — CID 114657456

IUPAC1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine
SMILESCCCCC(NC)c1c(OC)cnn1C
InChIInChI=1S/C11H21N3O/c1-5-6-7-9(12-2)11-10(15-4)8-13-14(11)3/h8-9,12H,5-7H2,1-4H3
InChIKeyXVIUURYNLULWIO-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.88
Rot. Bonds6

About 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine

1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine (PubChem CID 114657456) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine.

Molecular Properties

Compound Name1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine
PubChem CID114657456
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine
SMILESCCCCC(NC)c1c(OC)cnn1C
InChIInChI=1S/C11H21N3O/c1-5-6-7-9(12-2)11-10(15-4)8-13-14(11)3/h8-9,12H,5-7H2,1-4H3
InChIKeyXVIUURYNLULWIO-UHFFFAOYSA-N
XLogP1.88
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylnonan-1-amine
CID 105046852
4-methoxy-1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylbutan-1-amine
CID 114653379
N-ethyl-1-(4-methoxy-1-methylpyrazol-5-yl)hexan-1-amine
CID 105046940
1-(4-methoxy-1-methylpyrazol-5-yl)-N-propyloctan-1-amine
CID 105047055
1-(1-ethyl-4-methoxypyrazol-5-yl)-N-methyldecan-1-amine
CID 105047878
1-(4-methoxy-1-methylpyrazol-5-yl)-N-methyl-3-phenylpropan-1-amine
CID 114648431
3-(2,2-difluoroethoxy)-1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpropan-1-amine
CID 103149365
1-(4-methoxy-1-methylpyrazol-5-yl)hexan-1-amine
CID 105047246
1-(4-methoxy-1-methylpyrazol-5-yl)-2-(4-methoxyphenyl)-N-methylethanamine
CID 114648396
1-(1-ethyl-4-methoxypyrazol-5-yl)pentylhydrazine
CID 105245644
1-(1-ethyl-4-methoxypyrazol-5-yl)-3-methoxy-N-methylpropan-1-amine
CID 114648521
1-(4-methoxy-1-methylpyrazol-5-yl)-N',N'-dimethyl-N-propylethane-1,2-diamine
CID 114657283

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine?
The IUPAC name of 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine (CID 114657456) is 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine.
What is the SMILES notation for 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine?
The canonical SMILES for 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine is CCCCC(NC)c1c(OC)cnn1C.
What is the InChIKey of 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine?
The InChIKey is XVIUURYNLULWIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-5-6-7-9(12-2)11-10(15-4)8-13-14(11)3/h8-9,12H,5-7H2,1-4H3.
What are the key properties of 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine?
1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine has a molecular weight of 211.31 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-1-methylpyrazol-5-yl)-N-methylpentan-1-amine is sourced from PubChem (CID 114657456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).