2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine

C18H23FN2 — CID 63479739

IUPAC2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESCCCNc1c2c(nc3c(C)cc(F)cc13)CCCCC2
InChIInChI=1S/C18H23FN2/c1-3-9-20-18-14-7-5-4-6-8-16(14)21-17-12(2)10-13(19)11-15(17)18/h10-11H,3-9H2,1-2H3,(H,20,21)
InChIKeyOUBYGOUNZCDELR-UHFFFAOYSA-N
MW286.39 g/mol
LogP4.77
Rot. Bonds3

About 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine

2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (PubChem CID 63479739) has the molecular formula C18H23FN2 and a molecular weight of 286.39 g/mol. Its IUPAC name is 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.

Molecular Properties

Compound Name2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
PubChem CID63479739
Molecular FormulaC18H23FN2
Molecular Weight286.39 g/mol
Exact Mass286.18
IUPAC Name2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESCCCNc1c2c(nc3c(C)cc(F)cc13)CCCCC2
InChIInChI=1S/C18H23FN2/c1-3-9-20-18-14-7-5-4-6-8-16(14)21-17-12(2)10-13(19)11-15(17)18/h10-11H,3-9H2,1-2H3,(H,20,21)
InChIKeyOUBYGOUNZCDELR-UHFFFAOYSA-N
XLogP4.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.39
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine with MolForge

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Related Compounds

2-fluoro-4-iodo-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 79761506
4-chloro-2-fluoro-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63479762
4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63480102
7-fluoro-5-methoxy-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63482755
7-chloro-5-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63480982
6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 103996222
7-bromo-5,6-dichloro-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 107793865
N-ethyl-7-fluoro-5-iodo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 79771313
5,7-dibromo-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 63483296
5,7-dichloro-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 63481227
2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63479722
5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63479127

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The IUPAC name of 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (CID 63479739) is 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.
What is the SMILES notation for 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The canonical SMILES for 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is CCCNc1c2c(nc3c(C)cc(F)cc13)CCCCC2.
What is the InChIKey of 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The InChIKey is OUBYGOUNZCDELR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FN2/c1-3-9-20-18-14-7-5-4-6-8-16(14)21-17-12(2)10-13(19)11-15(17)18/h10-11H,3-9H2,1-2H3,(H,20,21).
What are the key properties of 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine has a molecular weight of 286.39 g/mol, XLogP of 4.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is sourced from PubChem (CID 63479739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).