5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine

C14H19N3O2 — CID 121374620

IUPAC5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine
SMILESCOc1ccc(COC(C)(C)c2cc(N)n[nH]2)cc1
InChIInChI=1S/C14H19N3O2/c1-14(2,12-8-13(15)17-16-12)19-9-10-4-6-11(18-3)7-5-10/h4-8H,9H2,1-3H3,(H3,15,16,17)
InChIKeyUPQXKIAREBLFJL-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.45
Rot. Bonds5

About 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine

5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine (PubChem CID 121374620) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine
PubChem CID121374620
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine
SMILESCOc1ccc(COC(C)(C)c2cc(N)n[nH]2)cc1
InChIInChI=1S/C14H19N3O2/c1-14(2,12-8-13(15)17-16-12)19-9-10-4-6-11(18-3)7-5-10/h4-8H,9H2,1-3H3,(H3,15,16,17)
InChIKeyUPQXKIAREBLFJL-UHFFFAOYSA-N
XLogP2.45
TPSA73.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methoxy-4-[(2-methylpropan-2-yl)oxymethyl]benzene
CID 11206354
5-[2-fluoro-6-[(4-methoxyphenyl)methoxy]phenyl]-1H-pyrazol-3-amine
CID 166147884
methyl 2-[(4-methoxyphenyl)methoxy]-2-methylpropanoate
CID 59570909
2-chloro-5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]pyrazine
CID 170721271
2-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]propan-2-amine
CID 83850457
4-N-[(4-methoxyphenyl)methyl]-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106770439
4-N-[(4-methoxyphenyl)methyl]-6-(trifluoromethyl)pyridine-2,4-diamine
CID 177043715
2-N-[(4-methoxyphenyl)methyl]-5-methylpyridine-2,4-diamine
CID 83265796
methane;O-[(4-methoxyphenyl)methyl]hydroxylamine
CID 142048761
5-(6-methoxy-1,3-benzothiazol-2-yl)-1H-pyrazol-3-amine
CID 79511841
5-[4-(2-methoxy-2-methylpropyl)phenyl]-1H-pyrazol-3-amine
CID 115111529
5-[(4-methoxyphenyl)methoxy]-2,5-dimethylhex-3-yn-2-ol
CID 102289994

Frequently Asked Questions

What is the IUPAC name of 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine?
The IUPAC name of 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine (CID 121374620) is 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine.
What is the SMILES notation for 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine?
The canonical SMILES for 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine is COc1ccc(COC(C)(C)c2cc(N)n[nH]2)cc1.
What is the InChIKey of 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine?
The InChIKey is UPQXKIAREBLFJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-14(2,12-8-13(15)17-16-12)19-9-10-4-6-11(18-3)7-5-10/h4-8H,9H2,1-3H3,(H3,15,16,17).
What are the key properties of 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine?
5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine has a molecular weight of 261.32 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[(4-methoxyphenyl)methoxy]propan-2-yl]-1H-pyrazol-3-amine is sourced from PubChem (CID 121374620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).