(3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol

C13H15Cl2N3O2 — CID 114644779

IUPAC(3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
SMILESCCCn1ncc(OC)c1C(O)c1ncc(Cl)cc1Cl
InChIInChI=1S/C13H15Cl2N3O2/c1-3-4-18-12(10(20-2)7-17-18)13(19)11-9(15)5-8(14)6-16-11/h5-7,13,19H,3-4H2,1-2H3
InChIKeyYKOQJMAJQODYPM-UHFFFAOYSA-N
MW316.19 g/mol
LogP3.09
Rot. Bonds5

About (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol

(3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol (PubChem CID 114644779) has the molecular formula C13H15Cl2N3O2 and a molecular weight of 316.19 g/mol. Its IUPAC name is (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol.

Molecular Properties

Compound Name(3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
PubChem CID114644779
Molecular FormulaC13H15Cl2N3O2
Molecular Weight316.19 g/mol
Exact Mass315.05
IUPAC Name(3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
SMILESCCCn1ncc(OC)c1C(O)c1ncc(Cl)cc1Cl
InChIInChI=1S/C13H15Cl2N3O2/c1-3-4-18-12(10(20-2)7-17-18)13(19)11-9(15)5-8(14)6-16-11/h5-7,13,19H,3-4H2,1-2H3
InChIKeyYKOQJMAJQODYPM-UHFFFAOYSA-N
XLogP3.09
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.19
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-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

(4-bromo-1-ethylpyrazol-5-yl)-(3,5-dichloro-2-pyridinyl)methanol
CID 114644778
(3-ethoxyphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114634160
1-(2,4-dichlorophenyl)-1-(4-methoxy-1-propylpyrazol-5-yl)-N-methylmethanamine
CID 105048863
(4-methoxy-1-propylpyrazol-5-yl)-(1,3-thiazol-2-yl)methanol
CID 114638165
(4-bromo-3,5-dimethylphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114645987
(2-ethoxyphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114634116
(2-fluoro-4-methoxyphenyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114645087
(4-methoxy-1-propylpyrazol-5-yl)-(3-propylimidazol-4-yl)methanol
CID 114636682
(1,5-dimethylpyrazol-4-yl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114636784
1-(4-methoxy-1-propylpyrazol-5-yl)pentan-1-ol
CID 114635614
(5-bromo-2-fluorophenyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol
CID 114634965
(3,5-dichlorophenyl)-(1-ethyl-4-methoxypyrazol-5-yl)methanol
CID 114635408

Frequently Asked Questions

What is the IUPAC name of (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol?
The IUPAC name of (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol (CID 114644779) is (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol.
What is the SMILES notation for (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol?
The canonical SMILES for (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol is CCCn1ncc(OC)c1C(O)c1ncc(Cl)cc1Cl.
What is the InChIKey of (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol?
The InChIKey is YKOQJMAJQODYPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N3O2/c1-3-4-18-12(10(20-2)7-17-18)13(19)11-9(15)5-8(14)6-16-11/h5-7,13,19H,3-4H2,1-2H3.
What are the key properties of (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol?
(3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol has a molecular weight of 316.19 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dichloro-2-pyridinyl)-(4-methoxy-1-propylpyrazol-5-yl)methanol is sourced from PubChem (CID 114644779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).