[4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol

C12H21N3O2 — CID 115824593

IUPAC[4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
SMILESCC(C)n1ccc(CN2CCOC(CO)C2)n1
InChIInChI=1S/C12H21N3O2/c1-10(2)15-4-3-11(13-15)7-14-5-6-17-12(8-14)9-16/h3-4,10,12,16H,5-9H2,1-2H3
InChIKeyHRROFFCHAGHOCF-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.66
Rot. Bonds4

About [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol

[4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol (PubChem CID 115824593) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
PubChem CID115824593
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC Name[4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
SMILESCC(C)n1ccc(CN2CCOC(CO)C2)n1
InChIInChI=1S/C12H21N3O2/c1-10(2)15-4-3-11(13-15)7-14-5-6-17-12(8-14)9-16/h3-4,10,12,16H,5-9H2,1-2H3
InChIKeyHRROFFCHAGHOCF-UHFFFAOYSA-N
XLogP0.66
TPSA50.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[4-[(1-butan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]acetate
CID 115537733
(2S)-2-(5-ethyl-1H-1,2,4-triazol-3-yl)-4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholine
CID 96997028
2-(5-ethyl-1H-1,2,4-triazol-3-yl)-4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholine
CID 71928113
[4-[(5-bromo-2-pyridinyl)methyl]morpholin-2-yl]methanol
CID 115681312
1-[(1-propan-2-ylpyrazol-3-yl)methyl]piperazine
CID 64771238
3-tert-butyl-1-[(1-propan-2-ylpyrazol-3-yl)methyl]piperazine
CID 64834620
[4-(pyridin-4-ylmethyl)morpholin-2-yl]methanol
CID 79841050
N-methyl-1-[(1-propan-2-ylpyrazol-3-yl)methyl]pyrrolidin-3-amine;hydrochloride
CID 119905844
[4-(1,3-thiazol-4-ylmethyl)morpholin-2-yl]methanol
CID 79833284
[1-[(1-propan-2-ylpyrazol-3-yl)methyl]pyrrolidin-3-yl]methanamine;hydrochloride
CID 119918076
N-methyl-1-[(1-propan-2-ylpyrazol-3-yl)methyl]piperidin-3-amine
CID 64771689
[4-[[1-(difluoromethyl)imidazol-2-yl]methyl]morpholin-2-yl]methanol
CID 113251773

Frequently Asked Questions

What is the IUPAC name of [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The IUPAC name of [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol (CID 115824593) is [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol.
What is the SMILES notation for [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The canonical SMILES for [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol is CC(C)n1ccc(CN2CCOC(CO)C2)n1.
What is the InChIKey of [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
The InChIKey is HRROFFCHAGHOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-10(2)15-4-3-11(13-15)7-14-5-6-17-12(8-14)9-16/h3-4,10,12,16H,5-9H2,1-2H3.
What are the key properties of [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol?
[4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol has a molecular weight of 239.32 g/mol, XLogP of 0.66, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(1-propan-2-ylpyrazol-3-yl)methyl]morpholin-2-yl]methanol is sourced from PubChem (CID 115824593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).