[1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol

C11H12BrN3O — CID 66437696

IUPAC[1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol
SMILESCCc1c(CO)cnn1-c1ccc(Br)cn1
InChIInChI=1S/C11H12BrN3O/c1-2-10-8(7-16)5-14-15(10)11-4-3-9(12)6-13-11/h3-6,16H,2,7H2,1H3
InChIKeyZMYYJVIEVZKSRU-UHFFFAOYSA-N
MW282.14 g/mol
LogP2.08
Rot. Bonds3

About [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol

[1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol (PubChem CID 66437696) has the molecular formula C11H12BrN3O and a molecular weight of 282.14 g/mol. Its IUPAC name is [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol
PubChem CID66437696
Molecular FormulaC11H12BrN3O
Molecular Weight282.14 g/mol
Exact Mass281.02
IUPAC Name[1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol
SMILESCCc1c(CO)cnn1-c1ccc(Br)cn1
InChIInChI=1S/C11H12BrN3O/c1-2-10-8(7-16)5-14-15(10)11-4-3-9(12)6-13-11/h3-6,16H,2,7H2,1H3
InChIKeyZMYYJVIEVZKSRU-UHFFFAOYSA-N
XLogP2.08
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.14
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-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

[1-(5-bromo-2-pyridinyl)-5-propan-2-ylpyrazol-4-yl]methanol
CID 66437474
[5-ethyl-1-(4-methyl-2-pyridinyl)pyrazol-4-yl]methanol
CID 66437686
(5-ethyl-1-pyridin-4-ylpyrazol-4-yl)methanol
CID 66439411
N-[[1-(5-bromo-2-pyridinyl)-5-propan-2-ylpyrazol-4-yl]methyl]ethanamine
CID 66440209
N-[[1-(5-bromo-2-pyridinyl)-5-propylpyrazol-4-yl]methyl]cyclopropanamine
CID 66440205
1-(5-bromo-2-pyridinyl)-3,5-diethylpyrazol-4-amine
CID 82702781
4-(bromomethyl)-1-(4-bromophenyl)-5-ethylpyrazole
CID 66439260
N-[[1-(5-bromo-2-pyridinyl)-5-methylpyrazol-4-yl]methyl]propan-2-amine
CID 65347734
[5-ethyl-1-(3,4,5-trifluorophenyl)pyrazol-4-yl]methanol
CID 79200351
5-bromo-2-[4-(bromomethyl)-5-(trifluoromethyl)pyrazol-1-yl]pyridine
CID 66439480
N-[[1-(5-bromo-2-pyridinyl)-5-propan-2-ylpyrazol-4-yl]methyl]propan-2-amine
CID 66440011
1-[1-(5-bromo-2-pyridinyl)-5-(trifluoromethyl)pyrazol-4-yl]-N-methylmethanamine
CID 66442611

Frequently Asked Questions

What is the IUPAC name of [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol?
The IUPAC name of [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol (CID 66437696) is [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol.
What is the SMILES notation for [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol?
The canonical SMILES for [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol is CCc1c(CO)cnn1-c1ccc(Br)cn1.
What is the InChIKey of [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol?
The InChIKey is ZMYYJVIEVZKSRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrN3O/c1-2-10-8(7-16)5-14-15(10)11-4-3-9(12)6-13-11/h3-6,16H,2,7H2,1H3.
What are the key properties of [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol?
[1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol has a molecular weight of 282.14 g/mol, XLogP of 2.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-bromo-2-pyridinyl)-5-ethylpyrazol-4-yl]methanol is sourced from PubChem (CID 66437696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).