(3-chloro-4-pyridinyl)-phenylmethanol

C12H10ClNO — CID 12602202

IUPAC(3-chloro-4-pyridinyl)-phenylmethanol
SMILESOC(c1ccccc1)c1ccncc1Cl
InChIInChI=1S/C12H10ClNO/c13-11-8-14-7-6-10(11)12(15)9-4-2-1-3-5-9/h1-8,12,15H
InChIKeyASILDIOFOLPMLX-UHFFFAOYSA-N
MW219.67 g/mol
LogP2.82
Rot. Bonds2

About (3-chloro-4-pyridinyl)-phenylmethanol

(3-chloro-4-pyridinyl)-phenylmethanol (PubChem CID 12602202) has the molecular formula C12H10ClNO and a molecular weight of 219.67 g/mol. Its IUPAC name is (3-chloro-4-pyridinyl)-phenylmethanol.

Molecular Properties

Compound Name(3-chloro-4-pyridinyl)-phenylmethanol
PubChem CID12602202
Molecular FormulaC12H10ClNO
Molecular Weight219.67 g/mol
Exact Mass219.05
IUPAC Name(3-chloro-4-pyridinyl)-phenylmethanol
SMILESOC(c1ccccc1)c1ccncc1Cl
InChIInChI=1S/C12H10ClNO/c13-11-8-14-7-6-10(11)12(15)9-4-2-1-3-5-9/h1-8,12,15H
InChIKeyASILDIOFOLPMLX-UHFFFAOYSA-N
XLogP2.82
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.67
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 234839
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CID 98305
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CID 7062237
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CID 74177
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CID 315585
CID 315585
CID 13762804
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CID 238376
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CID 3383504
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CID 177161
CID 177161
CID 97719
CID 97719
CID 2763647
CID 2763647

Frequently Asked Questions

What is the IUPAC name of (3-chloro-4-pyridinyl)-phenylmethanol?
The IUPAC name of (3-chloro-4-pyridinyl)-phenylmethanol (CID 12602202) is (3-chloro-4-pyridinyl)-phenylmethanol.
What is the SMILES notation for (3-chloro-4-pyridinyl)-phenylmethanol?
The canonical SMILES for (3-chloro-4-pyridinyl)-phenylmethanol is OC(c1ccccc1)c1ccncc1Cl.
What is the InChIKey of (3-chloro-4-pyridinyl)-phenylmethanol?
The InChIKey is ASILDIOFOLPMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO/c13-11-8-14-7-6-10(11)12(15)9-4-2-1-3-5-9/h1-8,12,15H.
What are the key properties of (3-chloro-4-pyridinyl)-phenylmethanol?
(3-chloro-4-pyridinyl)-phenylmethanol has a molecular weight of 219.67 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-4-pyridinyl)-phenylmethanol is sourced from PubChem (CID 12602202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).