5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine

C15H20N4O2 — CID 117465926

IUPAC5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine
SMILESCOc1ccc(-c2cc(N)n[nH]2)cc1CN1CCOCC1
InChIInChI=1S/C15H20N4O2/c1-20-14-3-2-11(13-9-15(16)18-17-13)8-12(14)10-19-4-6-21-7-5-19/h2-3,8-9H,4-7,10H2,1H3,(H3,16,17,18)
InChIKeyPFFJQAXAUJYMCT-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.50
Rot. Bonds4

About 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine

5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine (PubChem CID 117465926) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine
PubChem CID117465926
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine
SMILESCOc1ccc(-c2cc(N)n[nH]2)cc1CN1CCOCC1
InChIInChI=1S/C15H20N4O2/c1-20-14-3-2-11(13-9-15(16)18-17-13)8-12(14)10-19-4-6-21-7-5-19/h2-3,8-9H,4-7,10H2,1H3,(H3,16,17,18)
InChIKeyPFFJQAXAUJYMCT-UHFFFAOYSA-N
XLogP1.50
TPSA76.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[4-methoxy-3-(methoxymethyl)phenyl]-1H-pyrazol-3-amine
CID 117338097
4-[(5-chloro-2-methoxyphenyl)methyl]morpholine chloride
CID 53351457
4-[(5-chloro-2-methoxyphenyl)methyl]morpholine;hydrochloride
CID 16682270
O-[[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]methyl]hydroxylamine
CID 117384193
2-amino-4-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-6-oxo-1H-pyridine-3,5-dicarbonitrile
CID 169394058
5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine
CID 3480116
3-[4-methoxy-3-(pyrrolidin-1-ylmethyl)phenyl]-1-methylpyrazol-5-amine
CID 117462074
[2-methoxy-5-[5-(morpholin-4-ylmethyl)-2-pyridinyl]phenyl]methanol
CID 90399338
4-[3-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]propyl]morpholine
CID 170870160
2-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-2-oxoacetic acid
CID 117447646
4-[[2-methoxy-5-[3-(4-methylpiperazin-1-yl)propyl]phenyl]methyl]morpholine
CID 170863421
4-[(2,3,4-trimethoxyphenyl)methyl]morpholine
CID 782614

Frequently Asked Questions

What is the IUPAC name of 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine?
The IUPAC name of 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine (CID 117465926) is 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine.
What is the SMILES notation for 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine?
The canonical SMILES for 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine is COc1ccc(-c2cc(N)n[nH]2)cc1CN1CCOCC1.
What is the InChIKey of 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine?
The InChIKey is PFFJQAXAUJYMCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-20-14-3-2-11(13-9-15(16)18-17-13)8-12(14)10-19-4-6-21-7-5-19/h2-3,8-9H,4-7,10H2,1H3,(H3,16,17,18).
What are the key properties of 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine?
5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine has a molecular weight of 288.35 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-methoxy-3-(morpholin-4-ylmethyl)phenyl]-1H-pyrazol-3-amine is sourced from PubChem (CID 117465926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).