7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine

C16H19FN2O — CID 164634681

IUPAC7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine
SMILESCc1cc(N(C)C[C@H]2CCOC2)nc2cc(F)ccc12
InChIInChI=1S/C16H19FN2O/c1-11-7-16(19(2)9-12-5-6-20-10-12)18-15-8-13(17)3-4-14(11)15/h3-4,7-8,12H,5-6,9-10H2,1-2H3/t12-/m1/s1
InChIKeyVBKNMSCKVIFVEG-GFCCVEGCSA-N
MW274.34 g/mol
LogP3.16
Rot. Bonds3

About 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine

7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine (PubChem CID 164634681) has the molecular formula C16H19FN2O and a molecular weight of 274.34 g/mol. Its IUPAC name is 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine.

Molecular Properties

Compound Name7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine
PubChem CID164634681
Molecular FormulaC16H19FN2O
Molecular Weight274.34 g/mol
Exact Mass274.15
IUPAC Name7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine
SMILESCc1cc(N(C)C[C@H]2CCOC2)nc2cc(F)ccc12
InChIInChI=1S/C16H19FN2O/c1-11-7-16(19(2)9-12-5-6-20-10-12)18-15-8-13(17)3-4-14(11)15/h3-4,7-8,12H,5-6,9-10H2,1-2H3/t12-/m1/s1
InChIKeyVBKNMSCKVIFVEG-GFCCVEGCSA-N
XLogP3.16
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Methyl-2-(1-piperidinyl)quinoline
CID 230710
N,N-dimethylquinolin-2-amine
CID 588801
4-Phenanthridin-6-ylmorpholine
CID 823944
N,N-diethyl-4-methylquinolin-2-amine
CID 685004
4-(2-Fluoro-phenyl)-2-(4-methyl-piperazin-1-yl)-3-[2-(tetrahydro-furan-2-yloxy)-ethyl]-quinoline
CID 10741549
2-[4-(2-Fluoro-phenyl)-2-(4-methyl-piperazin-1-yl)-quinolin-3-yl]-ethanol
CID 44287078
4-Ethyl-3-methyl-2-(4-methylpiperazin-1-yl)quinoline
CID 44304233
(R)-2-(4-methylpiperidin-1-yl)-6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoline
CID 46890347
N-(cyclohexylmethyl)-4-methylquinolin-2-amine
CID 4826143
2-(2-Morpholin-4-yl-quinolin-3-ylmethylene)-malononitrile
CID 921753
2,6-Dimethyl-4-(4-methylquinolin-2-yl)morpholine
CID 5070263
4-Methyl-2-morpholinoquinoline
CID 812365

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine?
The IUPAC name of 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine (CID 164634681) is 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine.
What is the SMILES notation for 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine?
The canonical SMILES for 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine is Cc1cc(N(C)C[C@H]2CCOC2)nc2cc(F)ccc12.
What is the InChIKey of 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine?
The InChIKey is VBKNMSCKVIFVEG-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H19FN2O/c1-11-7-16(19(2)9-12-5-6-20-10-12)18-15-8-13(17)3-4-14(11)15/h3-4,7-8,12H,5-6,9-10H2,1-2H3/t12-/m1/s1.
What are the key properties of 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine?
7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine has a molecular weight of 274.34 g/mol, XLogP of 3.16, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N,4-dimethyl-N-[[(3R)-oxolan-3-yl]methyl]quinolin-2-amine is sourced from PubChem (CID 164634681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).