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

C18H24N2 — CID 63479722

IUPAC2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESCCCNc1c2c(nc3ccc(C)cc13)CCCCC2
InChIInChI=1S/C18H24N2/c1-3-11-19-18-14-7-5-4-6-8-16(14)20-17-10-9-13(2)12-15(17)18/h9-10,12H,3-8,11H2,1-2H3,(H,19,20)
InChIKeyNSVSTXMRGNBEGY-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.63
Rot. Bonds3

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

2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (PubChem CID 63479722) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.

Molecular Properties

Compound Name2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
PubChem CID63479722
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
SMILESCCCNc1c2c(nc3ccc(C)cc13)CCCCC2
InChIInChI=1S/C18H24N2/c1-3-11-19-18-14-7-5-4-6-8-16(14)20-17-10-9-13(2)12-15(17)18/h9-10,12H,3-8,11H2,1-2H3,(H,19,20)
InChIKeyNSVSTXMRGNBEGY-UHFFFAOYSA-N
XLogP4.63
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Tacrine
CID 1935
Proflavine
CID 7099
6-Methylquinoline
CID 7059
Acridine Orange Base
CID 62344
Dequalinium
CID 2993
Tacrine Hydrochloride
CID 2723754
9-Aminoacridine
CID 7019
3,6-Diamino-10-methylacridinium Chloride
CID 6842
9-Aminoacridine hydrochloride
CID 8643
2,6-Dimethylquinoline
CID 13414
4-Amino-2-methylquinoline
CID 81116
5-Aminoquinoline
CID 11911

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The IUPAC name of 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine (CID 63479722) is 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine.
What is the SMILES notation for 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The canonical SMILES for 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is CCCNc1c2c(nc3ccc(C)cc13)CCCCC2.
What is the InChIKey of 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
The InChIKey is NSVSTXMRGNBEGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-3-11-19-18-14-7-5-4-6-8-16(14)20-17-10-9-13(2)12-15(17)18/h9-10,12H,3-8,11H2,1-2H3,(H,19,20).
What are the key properties of 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine?
2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine has a molecular weight of 268.40 g/mol, XLogP of 4.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine is sourced from PubChem (CID 63479722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).