1-(7-fluoroquinolin-2-yl)propan-2-amine

C12H13FN2 — CID 82241374

IUPAC1-(7-fluoroquinolin-2-yl)propan-2-amine
SMILESCC(N)Cc1ccc2ccc(F)cc2n1
InChIInChI=1S/C12H13FN2/c1-8(14)6-11-5-3-9-2-4-10(13)7-12(9)15-11/h2-5,7-8H,6,14H2,1H3
InChIKeyJXALHLYKSZGRRO-UHFFFAOYSA-N
MW204.25 g/mol
LogP2.26
Rot. Bonds2

About 1-(7-fluoroquinolin-2-yl)propan-2-amine

1-(7-fluoroquinolin-2-yl)propan-2-amine (PubChem CID 82241374) has the molecular formula C12H13FN2 and a molecular weight of 204.25 g/mol. Its IUPAC name is 1-(7-fluoroquinolin-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(7-fluoroquinolin-2-yl)propan-2-amine
PubChem CID82241374
Molecular FormulaC12H13FN2
Molecular Weight204.25 g/mol
Exact Mass204.11
IUPAC Name1-(7-fluoroquinolin-2-yl)propan-2-amine
SMILESCC(N)Cc1ccc2ccc(F)cc2n1
InChIInChI=1S/C12H13FN2/c1-8(14)6-11-5-3-9-2-4-10(13)7-12(9)15-11/h2-5,7-8H,6,14H2,1H3
InChIKeyJXALHLYKSZGRRO-UHFFFAOYSA-N
XLogP2.26
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(7-fluoroquinolin-2-yl)-2-methylpropanoic acid
CID 82243062
2-ethyl-7-fluoroquinoline
CID 118449779
1-(2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-7-yl)propan-2-amine
CID 82244039
1-(7-fluoroquinolin-2-yl)propan-2-one
CID 82241337
1-(7-fluoroquinazolin-2-yl)ethanamine
CID 105444819
1-(6-fluoro-2H-indazol-3-yl)propan-2-amine
CID 83907519
1-[2-(2-bromo-5-fluorophenyl)pyrimidin-4-yl]propan-2-amine
CID 114016403
1-(2-chloro-4-fluorophenyl)propan-2-amine
CID 62600100
1-(4-fluorophenyl)-2-quinolin-2-ylethanamine
CID 43118778
(2R)-1-(5-fluoro-2H-indazol-3-yl)propan-2-amine
CID 92670275
N-butan-2-yl-3-(7-fluoroquinolin-2-yl)propanamide
CID 110486620
1-(2,4-difluorophenyl)propan-2-amine;hydrochloride
CID 155973682

Frequently Asked Questions

What is the IUPAC name of 1-(7-fluoroquinolin-2-yl)propan-2-amine?
The IUPAC name of 1-(7-fluoroquinolin-2-yl)propan-2-amine (CID 82241374) is 1-(7-fluoroquinolin-2-yl)propan-2-amine.
What is the SMILES notation for 1-(7-fluoroquinolin-2-yl)propan-2-amine?
The canonical SMILES for 1-(7-fluoroquinolin-2-yl)propan-2-amine is CC(N)Cc1ccc2ccc(F)cc2n1.
What is the InChIKey of 1-(7-fluoroquinolin-2-yl)propan-2-amine?
The InChIKey is JXALHLYKSZGRRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN2/c1-8(14)6-11-5-3-9-2-4-10(13)7-12(9)15-11/h2-5,7-8H,6,14H2,1H3.
What are the key properties of 1-(7-fluoroquinolin-2-yl)propan-2-amine?
1-(7-fluoroquinolin-2-yl)propan-2-amine has a molecular weight of 204.25 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7-fluoroquinolin-2-yl)propan-2-amine is sourced from PubChem (CID 82241374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).