(5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone

C15H12FNO — CID 63080715

IUPAC(5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone
SMILESO=C(c1cncc(F)c1)C1(c2ccccc2)CC1
InChIInChI=1S/C15H12FNO/c16-13-8-11(9-17-10-13)14(18)15(6-7-15)12-4-2-1-3-5-12/h1-5,8-10H,6-7H2
InChIKeyUKAUUOLQWNTZKP-UHFFFAOYSA-N
MW241.27 g/mol
LogP3.14
Rot. Bonds3

About (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone

(5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone (PubChem CID 63080715) has the molecular formula C15H12FNO and a molecular weight of 241.27 g/mol. Its IUPAC name is (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone.

Molecular Properties

Compound Name(5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone
PubChem CID63080715
Molecular FormulaC15H12FNO
Molecular Weight241.27 g/mol
Exact Mass241.09
IUPAC Name(5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone
SMILESO=C(c1cncc(F)c1)C1(c2ccccc2)CC1
InChIInChI=1S/C15H12FNO/c16-13-8-11(9-17-10-13)14(18)15(6-7-15)12-4-2-1-3-5-12/h1-5,8-10H,6-7H2
InChIKeyUKAUUOLQWNTZKP-UHFFFAOYSA-N
XLogP3.14
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.27
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(5-methyl-3-pyridinyl)-(4-phenylpiperidin-4-yl)methanone
CID 116561879
(3-bromo-4-fluorophenyl)-(1-phenylcyclopropyl)methanone
CID 79735854
1-(5-fluoro-3-pyridinyl)-3-phenylpropane-1,3-dione
CID 114080622
N-[1-(5-fluoro-3-pyridinyl)pyrazol-3-yl]-1-phenylcyclopropane-1-carboxamide
CID 134589086
N-[[(1R)-2,2-dimethyl-1-phenylcyclopropyl]methyl]-5-fluoro-N-methylpyridine-3-carboxamide
CID 126431971
1-[6-[(5-fluoropyridine-3-carbonyl)amino]-3-pyridinyl]cyclobutane-1-carboxylic acid
CID 137463496
(3-fluoro-4-methylphenyl)-(1-phenylcyclobutyl)methanone
CID 107128300
cis-(1S,3S)-3-(5-fluoro-3-pyridinyl)-N-hydroxy-1-phenylcyclopentane-1-carboxamide
CID 86274412
cis-(1S,3S)-3-(5-fluoro-3-pyridinyl)-N-hydroxy-1-phenylcyclopentane-1-carboxamide;sulfane
CID 158584645
(5-fluoro-3-pyridinyl)-(2-methylpyrrolidin-2-yl)methanone
CID 116580596
4-(1-phenylcyclopropanecarbonyl)-1H-pyrrole-2-carboxylic acid
CID 62877078
(2-fluoro-5-methylphenyl)-(1-phenylcyclopropyl)methanone
CID 55181920

Frequently Asked Questions

What is the IUPAC name of (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone?
The IUPAC name of (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone (CID 63080715) is (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone.
What is the SMILES notation for (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone?
The canonical SMILES for (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone is O=C(c1cncc(F)c1)C1(c2ccccc2)CC1.
What is the InChIKey of (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone?
The InChIKey is UKAUUOLQWNTZKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FNO/c16-13-8-11(9-17-10-13)14(18)15(6-7-15)12-4-2-1-3-5-12/h1-5,8-10H,6-7H2.
What are the key properties of (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone?
(5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone has a molecular weight of 241.27 g/mol, XLogP of 3.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-fluoro-3-pyridinyl)-(1-phenylcyclopropyl)methanone is sourced from PubChem (CID 63080715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).