1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol

C9H11Cl2NO — CID 79780293

IUPAC1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol
SMILESCC(C)C(O)c1ncc(Cl)cc1Cl
InChIInChI=1S/C9H11Cl2NO/c1-5(2)9(13)8-7(11)3-6(10)4-12-8/h3-5,9,13H,1-2H3
InChIKeyIKNHSGGMBQZNOF-UHFFFAOYSA-N
MW220.10 g/mol
LogP3.08
Rot. Bonds2

About 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol

1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol (PubChem CID 79780293) has the molecular formula C9H11Cl2NO and a molecular weight of 220.10 g/mol. Its IUPAC name is 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol
PubChem CID79780293
Molecular FormulaC9H11Cl2NO
Molecular Weight220.10 g/mol
Exact Mass219.02
IUPAC Name1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol
SMILESCC(C)C(O)c1ncc(Cl)cc1Cl
InChIInChI=1S/C9H11Cl2NO/c1-5(2)9(13)8-7(11)3-6(10)4-12-8/h3-5,9,13H,1-2H3
InChIKeyIKNHSGGMBQZNOF-UHFFFAOYSA-N
XLogP3.08
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.10
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol 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-(3,5-dichloro-2-pyridinyl)-N-ethylpropan-1-amine
CID 79781049
3,5-dichloro-2-(difluoromethyl)pyridine
CID 60622989
ethyl 4-(3,5-dichloro-2-pyridinyl)-3,4-dihydroxybutanoate
CID 171897131
1-(3,5-dichloro-2-pyridinyl)-N,2-dimethylprop-2-en-1-amine
CID 79780550
1-(2-bromo-5-chloro-3-pyridinyl)-2-methylpropan-1-ol
CID 175958580
1-(3-bromo-5-chloro-2-pyridinyl)ethanol
CID 71744171
1-(3,5-dichloro-2-pyridinyl)-N-ethylethanamine
CID 79780970
1-(3,5-dichloro-2-pyridinyl)-3-methylidenepentan-1-ol
CID 79780608
(2S)-2-(3,5-dichloro-2-pyridinyl)-2-(methylamino)ethanol
CID 131218477
(3,5-dichloro-2-pyridinyl)-(1-methylpyrazol-4-yl)methanol
CID 79780527
(3,5-dichloro-2-pyridinyl)-pyrazin-2-ylmethanol
CID 79779870
1-(3,5-dichloro-2-pyridinyl)-N-methyl-1-(4-propan-2-ylphenyl)methanamine
CID 79780803

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol?
The IUPAC name of 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol (CID 79780293) is 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol.
What is the SMILES notation for 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol?
The canonical SMILES for 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol is CC(C)C(O)c1ncc(Cl)cc1Cl.
What is the InChIKey of 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol?
The InChIKey is IKNHSGGMBQZNOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2NO/c1-5(2)9(13)8-7(11)3-6(10)4-12-8/h3-5,9,13H,1-2H3.
What are the key properties of 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol?
1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol has a molecular weight of 220.10 g/mol, XLogP of 3.08, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichloro-2-pyridinyl)-2-methylpropan-1-ol is sourced from PubChem (CID 79780293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).