(1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol

C18H25N3O3 — CID 171763291

IUPAC(1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol
SMILESCc1nn(C)cc1C(O)c1ccccc1OCCN1CCOCC1
InChIInChI=1S/C18H25N3O3/c1-14-16(13-20(2)19-14)18(22)15-5-3-4-6-17(15)24-12-9-21-7-10-23-11-8-21/h3-6,13,18,22H,7-12H2,1-2H3
InChIKeyDRDWGZUWNWRLSG-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.52
Rot. Bonds6

About (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol

(1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol (PubChem CID 171763291) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol.

Molecular Properties

Compound Name(1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol
PubChem CID171763291
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name(1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol
SMILESCc1nn(C)cc1C(O)c1ccccc1OCCN1CCOCC1
InChIInChI=1S/C18H25N3O3/c1-14-16(13-20(2)19-14)18(22)15-5-3-4-6-17(15)24-12-9-21-7-10-23-11-8-21/h3-6,13,18,22H,7-12H2,1-2H3
InChIKeyDRDWGZUWNWRLSG-UHFFFAOYSA-N
XLogP1.52
TPSA59.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[3-ethyl-1-(trideuteriomethyl)pyrazol-4-yl]-[2-(2-morpholin-4-ylethoxy)phenyl]methanol
CID 171763268
(1S)-1-[2-(2-morpholin-4-ylethoxy)phenyl]ethanamine
CID 78936484
ethane;4-[2-(2-methylphenoxy)ethyl]morpholine
CID 144752549
1-[5-methyl-2-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 43505269
2-methyl-1-[2-(2-morpholin-4-ylethoxy)phenyl]propan-1-one
CID 118041363
4-[2-[2-(2-butan-2-ylphenoxy)ethoxy]ethyl]morpholine
CID 2923927
4-[2-[2-(2,4-dimethylpyrazolo[3,4-b]pyridin-6-yl)phenoxy]ethyl]morpholine
CID 169419591
4-[2-(5-phenyl-2-propan-2-ylphenoxy)ethyl]morpholine
CID 146386321
N,N-dimethyl-2-(2-morpholin-4-ylethoxy)aniline
CID 147491623
2-[2-(2-morpholin-4-ylethoxy)phenyl]ethanol
CID 107713272
4-[2-[2-(chloromethyl)phenoxy]ethyl]morpholine
CID 18179953
1-[2-(2-piperidin-1-ylethoxy)phenyl]propan-1-ol
CID 43503527

Frequently Asked Questions

What is the IUPAC name of (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol?
The IUPAC name of (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol (CID 171763291) is (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol.
What is the SMILES notation for (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol?
The canonical SMILES for (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol is Cc1nn(C)cc1C(O)c1ccccc1OCCN1CCOCC1.
What is the InChIKey of (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol?
The InChIKey is DRDWGZUWNWRLSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-14-16(13-20(2)19-14)18(22)15-5-3-4-6-17(15)24-12-9-21-7-10-23-11-8-21/h3-6,13,18,22H,7-12H2,1-2H3.
What are the key properties of (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol?
(1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol has a molecular weight of 331.42 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-dimethylpyrazol-4-yl)-[2-(2-morpholin-4-ylethoxy)phenyl]methanol is sourced from PubChem (CID 171763291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).