[5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol

C14H15ClN2O — CID 12640228

IUPAC[5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol
SMILESCN(Cc1cccc(Cl)c1)c1ccc(CO)nc1
InChIInChI=1S/C14H15ClN2O/c1-17(9-11-3-2-4-12(15)7-11)14-6-5-13(10-18)16-8-14/h2-8,18H,9-10H2,1H3
InChIKeyKFWSAWIPZMXNCU-UHFFFAOYSA-N
MW262.74 g/mol
LogP2.86
Rot. Bonds4

About [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol

[5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol (PubChem CID 12640228) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol
PubChem CID12640228
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name[5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol
SMILESCN(Cc1cccc(Cl)c1)c1ccc(CO)nc1
InChIInChI=1S/C14H15ClN2O/c1-17(9-11-3-2-4-12(15)7-11)14-6-5-13(10-18)16-8-14/h2-8,18H,9-10H2,1H3
InChIKeyKFWSAWIPZMXNCU-UHFFFAOYSA-N
XLogP2.86
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol?
The IUPAC name of [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol (CID 12640228) is [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol.
What is the SMILES notation for [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol?
The canonical SMILES for [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol is CN(Cc1cccc(Cl)c1)c1ccc(CO)nc1.
What is the InChIKey of [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol?
The InChIKey is KFWSAWIPZMXNCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-17(9-11-3-2-4-12(15)7-11)14-6-5-13(10-18)16-8-14/h2-8,18H,9-10H2,1H3.
What are the key properties of [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol?
[5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol has a molecular weight of 262.74 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(3-chlorophenyl)methyl-methylamino]-2-pyridinyl]methanol is sourced from PubChem (CID 12640228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).