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

C18H23FN2 — CID 63480102

IUPAC4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESCCCNc1c2c(nc3c(F)cc(C)cc13)CCCCC2
InChIInChI=1S/C18H23FN2/c1-3-9-20-17-13-7-5-4-6-8-16(13)21-18-14(17)10-12(2)11-15(18)19/h10-11H,3-9H2,1-2H3,(H,20,21)
InChIKeyDYSQQJCDPRSHFO-UHFFFAOYSA-N
MW286.39 g/mol
LogP4.77
Rot. Bonds3

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

4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (PubChem CID 63480102) has the molecular formula C18H23FN2 and a molecular weight of 286.39 g/mol. Its IUPAC name is 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.

Molecular Properties

Compound Name4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
PubChem CID63480102
Molecular FormulaC18H23FN2
Molecular Weight286.39 g/mol
Exact Mass286.18
IUPAC Name4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESCCCNc1c2c(nc3c(F)cc(C)cc13)CCCCC2
InChIInChI=1S/C18H23FN2/c1-3-9-20-17-13-7-5-4-6-8-16(13)21-18-14(17)10-12(2)11-15(18)19/h10-11H,3-9H2,1-2H3,(H,20,21)
InChIKeyDYSQQJCDPRSHFO-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 4-fluoro-2-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-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63479739
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
6-fluoro-7-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 103996222
2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63479722
7-chloro-5-methyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63480982
7-fluoro-5-methoxy-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63482755
5,7-dibromo-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 63483296
7-bromo-5,6-dichloro-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 107793865
5-fluoro-7-methyl-1,2,3,4-tetrahydroacridin-9-amine
CID 55045940
5,7-dichloro-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 63481227
5,8-dimethyl-N-propyl-1,2,3,4-tetrahydroacridin-9-amine
CID 63479127

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The IUPAC name of 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (CID 63480102) is 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.
What is the SMILES notation for 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The canonical SMILES for 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is CCCNc1c2c(nc3c(F)cc(C)cc13)CCCCC2.
What is the InChIKey of 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The InChIKey is DYSQQJCDPRSHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FN2/c1-3-9-20-17-13-7-5-4-6-8-16(13)21-18-14(17)10-12(2)11-15(18)19/h10-11H,3-9H2,1-2H3,(H,20,21).
What are the key properties of 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
4-fluoro-2-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 4-fluoro-2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is sourced from PubChem (CID 63480102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).