(3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol

C15H14FNO — CID 116517288

IUPAC(3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol
SMILESOC(c1ccncc1F)C1CC1c1ccccc1
InChIInChI=1S/C15H14FNO/c16-14-9-17-7-6-11(14)15(18)13-8-12(13)10-4-2-1-3-5-10/h1-7,9,12-13,15,18H,8H2
InChIKeyLOQMQTLUDFBEMN-UHFFFAOYSA-N
MW243.28 g/mol
LogP3.06
Rot. Bonds3

About (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol

(3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol (PubChem CID 116517288) has the molecular formula C15H14FNO and a molecular weight of 243.28 g/mol. Its IUPAC name is (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol.

Molecular Properties

Compound Name(3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol
PubChem CID116517288
Molecular FormulaC15H14FNO
Molecular Weight243.28 g/mol
Exact Mass243.11
IUPAC Name(3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol
SMILESOC(c1ccncc1F)C1CC1c1ccccc1
InChIInChI=1S/C15H14FNO/c16-14-9-17-7-6-11(14)15(18)13-8-12(13)10-4-2-1-3-5-10/h1-7,9,12-13,15,18H,8H2
InChIKeyLOQMQTLUDFBEMN-UHFFFAOYSA-N
XLogP3.06
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.28
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-fluoro-4-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 116517836
N-[(3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methyl]ethanamine
CID 116517837
(2-methylsulfanylphenyl)-(2-phenylcyclopropyl)methanol
CID 115838733
(2-methyl-3-pyridinyl)-(2-phenylcyclopropyl)methanol
CID 105131922
2,3-dihydro-1-benzofuran-2-yl-(3-fluoro-4-pyridinyl)methanol
CID 104738109
6-bicyclo[3.1.0]hexanyl-(3-fluoro-4-pyridinyl)methanol
CID 115833955
(3-methylimidazol-4-yl)-(2-phenylcyclopropyl)methanol
CID 116516866
(3-methoxy-4-pyridinyl)-(2-phenylcyclopropyl)methanamine
CID 105066143
1-(3-methoxy-4-pyridinyl)-N-methyl-1-(2-phenylcyclopropyl)methanamine
CID 105066144
1-cyclopropyl-2-(3-fluoro-4-pyridinyl)ethane-1,2-diol
CID 103456925
1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naphthalen-1-yl-(3-fluoro-4-pyridinyl)methanol
CID 115833981
2-(3-fluoro-4-pyridinyl)-2-hydroxyacetic acid
CID 104737624

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol?
The IUPAC name of (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol (CID 116517288) is (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol.
What is the SMILES notation for (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol?
The canonical SMILES for (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol is OC(c1ccncc1F)C1CC1c1ccccc1.
What is the InChIKey of (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol?
The InChIKey is LOQMQTLUDFBEMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO/c16-14-9-17-7-6-11(14)15(18)13-8-12(13)10-4-2-1-3-5-10/h1-7,9,12-13,15,18H,8H2.
What are the key properties of (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol?
(3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol has a molecular weight of 243.28 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-pyridinyl)-(2-phenylcyclopropyl)methanol is sourced from PubChem (CID 116517288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).