2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine

C18H15FN2 — CID 163732207

IUPAC2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine
SMILESNc1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
InChIInChI=1S/C18H15FN2/c19-13-9-7-11(8-10-13)16-14-3-1-2-4-15(14)21-18(17(16)20)12-5-6-12/h1-4,7-10,12H,5-6,20H2
InChIKeyLANWECUKPYQQAZ-UHFFFAOYSA-N
MW278.33 g/mol
LogP4.50
Rot. Bonds2

About 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine

2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine (PubChem CID 163732207) has the molecular formula C18H15FN2 and a molecular weight of 278.33 g/mol. Its IUPAC name is 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine.

Molecular Properties

Compound Name2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine
PubChem CID163732207
Molecular FormulaC18H15FN2
Molecular Weight278.33 g/mol
Exact Mass278.12
IUPAC Name2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine
SMILESNc1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1
InChIInChI=1S/C18H15FN2/c19-13-9-7-11(8-10-13)16-14-3-1-2-4-15(14)21-18(17(16)20)12-5-6-12/h1-4,7-10,12H,5-6,20H2
InChIKeyLANWECUKPYQQAZ-UHFFFAOYSA-N
XLogP4.50
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-triphenylphosphanium
CID 87095849
2-cyclopropyl-4-(4-fluorophenyl)-3-(oxiran-2-ylmethyl)quinoline
CID 87120778
2-cyclopropyl-4-(4-fluorophenyl)-3-(2-methylsulfanylethenyl)quinoline
CID 123797068
(E)-3-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]prop-2-en-1-ol
CID 15480490
bromo-[[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]methyl]-triethoxy-λ5-phosphane
CID 142709376
2-cyclopropyl-3-(diethoxyphosphorylmethyl)-4-(4-fluorophenyl)quinoline
CID 46897065
1-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3-(1,3-dioxolan-2-yl)propan-1-ol
CID 66714892
(E)-1-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]hept-1-ene-3,5-diol
CID 22412416
calcium;bis((E,1R,3R,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-1,3,5-trihydroxyhept-6-en-1-olate);pentahydrate
CID 140809264
2-cyclopropyl-3-[2-[(4S)-2,2-dimethyl-1,3-dioxan-4-yl]ethenyl]-4-(4-fluorophenyl)quinoline
CID 175698373
(4S,6R)-6-[(E)-2-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]ethenyl]-4-hydroxyoxan-2-one
CID 11003967
(Z,3S,5S)-7-[2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-yl]-3,5-dihydroxyhept-6-enoic acid
CID 100942119

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine?
The IUPAC name of 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine (CID 163732207) is 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine.
What is the SMILES notation for 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine?
The canonical SMILES for 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine is Nc1c(C2CC2)nc2ccccc2c1-c1ccc(F)cc1.
What is the InChIKey of 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine?
The InChIKey is LANWECUKPYQQAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2/c19-13-9-7-11(8-10-13)16-14-3-1-2-4-15(14)21-18(17(16)20)12-5-6-12/h1-4,7-10,12H,5-6,20H2.
What are the key properties of 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine?
2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine has a molecular weight of 278.33 g/mol, XLogP of 4.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-4-(4-fluorophenyl)quinolin-3-amine is sourced from PubChem (CID 163732207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).