[3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol

C14H15FN2O — CID 75436066

IUPAC[3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol
SMILESCc1ccc(F)c(CNc2cnccc2CO)c1
InChIInChI=1S/C14H15FN2O/c1-10-2-3-13(15)12(6-10)7-17-14-8-16-5-4-11(14)9-18/h2-6,8,17-18H,7,9H2,1H3
InChIKeyBEEMLQHUIDESRN-UHFFFAOYSA-N
MW246.28 g/mol
LogP2.63
Rot. Bonds4

About [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol

[3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol (PubChem CID 75436066) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol.

Molecular Properties

Compound Name[3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol
PubChem CID75436066
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name[3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol
SMILESCc1ccc(F)c(CNc2cnccc2CO)c1
InChIInChI=1S/C14H15FN2O/c1-10-2-3-13(15)12(6-10)7-17-14-8-16-5-4-11(14)9-18/h2-6,8,17-18H,7,9H2,1H3
InChIKeyBEEMLQHUIDESRN-UHFFFAOYSA-N
XLogP2.63
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[3-[(2,4-dimethylphenyl)methylamino]-4-pyridinyl]methanol
CID 71845475
2-fluoro-N-[(2-fluoro-5-methylphenyl)methyl]-5-methylaniline
CID 114053781
N-[(2-fluoro-5-methylphenyl)methyl]-5-methylpyridin-3-amine
CID 103824043
2-chloro-N-[(2-fluoro-5-methylphenyl)methyl]-5-methylaniline
CID 114053971
[3-[(3-methylthiophen-2-yl)methylamino]-4-pyridinyl]methanol
CID 115749542
[3-[[5-(4-fluoro-2-methylphenyl)furan-2-yl]methylamino]-4-pyridinyl]methanol
CID 99620226
2-chloro-N-[(2-fluoro-5-methylphenyl)methyl]aniline
CID 114053756
N-[(2-fluoro-5-methylphenyl)methyl]-2-methoxy-5-methylaniline
CID 103818113
N-[(2-fluoro-5-methylphenyl)methyl]ethanamine
CID 61033867
4-chloro-N-[(2-fluoro-5-methylphenyl)methyl]aniline
CID 114053753
2-chloro-N-[(5-chloro-2-fluorophenyl)methyl]-4-methylaniline
CID 114841500
N-[(2,4-difluorophenyl)methyl]-4-methylpyridin-3-amine
CID 63329924

Frequently Asked Questions

What is the IUPAC name of [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol?
The IUPAC name of [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol (CID 75436066) is [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol.
What is the SMILES notation for [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol?
The canonical SMILES for [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol is Cc1ccc(F)c(CNc2cnccc2CO)c1.
What is the InChIKey of [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol?
The InChIKey is BEEMLQHUIDESRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-10-2-3-13(15)12(6-10)7-17-14-8-16-5-4-11(14)9-18/h2-6,8,17-18H,7,9H2,1H3.
What are the key properties of [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol?
[3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol has a molecular weight of 246.28 g/mol, XLogP of 2.63, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2-fluoro-5-methylphenyl)methylamino]-4-pyridinyl]methanol is sourced from PubChem (CID 75436066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).