5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine

C12H22N4O — CID 114256042

IUPAC5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine
SMILESCOc1cc(NCCC2CCNCC2)nn1C
InChIInChI=1S/C12H22N4O/c1-16-12(17-2)9-11(15-16)14-8-5-10-3-6-13-7-4-10/h9-10,13H,3-8H2,1-2H3,(H,14,15)
InChIKeyPTSOIEUFZJTLFF-UHFFFAOYSA-N
MW238.33 g/mol
LogP1.23
Rot. Bonds5

About 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine

5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine (PubChem CID 114256042) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine.

Molecular Properties

Compound Name5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine
PubChem CID114256042
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Name5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine
SMILESCOc1cc(NCCC2CCNCC2)nn1C
InChIInChI=1S/C12H22N4O/c1-16-12(17-2)9-11(15-16)14-8-5-10-3-6-13-7-4-10/h9-10,13H,3-8H2,1-2H3,(H,14,15)
InChIKeyPTSOIEUFZJTLFF-UHFFFAOYSA-N
XLogP1.23
TPSA51.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methoxy-1-methyl-N-(3-piperidin-2-ylpropyl)pyrazol-3-amine
CID 114256072
5-methoxy-1-methyl-N-[(1-methylpiperidin-4-yl)methyl]pyrazol-3-amine
CID 114255682
2,5-dimethyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine
CID 103568968
1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-4-amine
CID 103568741
2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline
CID 115211539
5-methyl-N-(2-piperidin-4-ylethyl)pyridin-2-amine
CID 83837473
N-(2-piperidin-4-ylethyl)-6-propylpyridazin-3-amine
CID 116972215
N-[2-(aminomethyl)cyclohexyl]-5-methoxy-1-methylpyrazol-3-amine
CID 114255669
5-methyl-N-(2-piperidin-4-ylethyl)pyrimidin-2-amine
CID 116975989
6-(2-methylpropyl)-N-(2-piperidin-4-ylethyl)pyridazin-3-amine
CID 116972216
1-tert-butyl-N-(2-piperidin-4-ylethyl)imidazol-2-amine
CID 115055136
4-[2-(4-tert-butylimidazol-1-yl)ethyl]piperidine
CID 82513262

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine?
The IUPAC name of 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine (CID 114256042) is 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine.
What is the SMILES notation for 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine?
The canonical SMILES for 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine is COc1cc(NCCC2CCNCC2)nn1C.
What is the InChIKey of 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine?
The InChIKey is PTSOIEUFZJTLFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-16-12(17-2)9-11(15-16)14-8-5-10-3-6-13-7-4-10/h9-10,13H,3-8H2,1-2H3,(H,14,15).
What are the key properties of 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine?
5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine has a molecular weight of 238.33 g/mol, XLogP of 1.23, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine is sourced from PubChem (CID 114256042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).