6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

C16H17BrN2O — CID 106473321

IUPAC6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCc1ccc2c(NC3CC3)c3c(nc2c1Br)CCOC3
InChIInChI=1S/C16H17BrN2O/c1-9-2-5-11-15(18-10-3-4-10)12-8-20-7-6-13(12)19-16(11)14(9)17/h2,5,10H,3-4,6-8H2,1H3,(H,18,19)
InChIKeyFPIZWHNWIJWSSB-UHFFFAOYSA-N
MW333.23 g/mol
LogP3.95
Rot. Bonds2

About 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine

6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (PubChem CID 106473321) has the molecular formula C16H17BrN2O and a molecular weight of 333.23 g/mol. Its IUPAC name is 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.

Molecular Properties

Compound Name6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
PubChem CID106473321
Molecular FormulaC16H17BrN2O
Molecular Weight333.23 g/mol
Exact Mass332.05
IUPAC Name6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
SMILESCc1ccc2c(NC3CC3)c3c(nc2c1Br)CCOC3
InChIInChI=1S/C16H17BrN2O/c1-9-2-5-11-15(18-10-3-4-10)12-8-20-7-6-13(12)19-16(11)14(9)17/h2,5,10H,3-4,6-8H2,1H3,(H,18,19)
InChIKeyFPIZWHNWIJWSSB-UHFFFAOYSA-N
XLogP3.95
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.23
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine with MolForge

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Launch Full Analysis

Related Compounds

6-bromo-N,7-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473322
N-cyclopropyl-6-methoxy-9-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473061
8-bromo-N-cyclopropyl-7,9-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 107578774
N-cyclopropyl-8-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473014
7-bromo-6-methyl-N-propyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 107628659
6-methyl-N-propyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473206
6-bromo-9-methyl-N-propyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473323
9-fluoro-N,6-dimethyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473134
N-cyclopropyl-7,8,9-trifluoro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473275
8-bromo-6-chloro-N-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473049
(6,7-dichloro-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-yl)hydrazine
CID 106473737
8-chloro-N-ethyl-6-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine
CID 106473178

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The IUPAC name of 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine (CID 106473321) is 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine.
What is the SMILES notation for 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The canonical SMILES for 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is Cc1ccc2c(NC3CC3)c3c(nc2c1Br)CCOC3.
What is the InChIKey of 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
The InChIKey is FPIZWHNWIJWSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17BrN2O/c1-9-2-5-11-15(18-10-3-4-10)12-8-20-7-6-13(12)19-16(11)14(9)17/h2,5,10H,3-4,6-8H2,1H3,(H,18,19).
What are the key properties of 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine?
6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine has a molecular weight of 333.23 g/mol, XLogP of 3.95, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-cyclopropyl-7-methyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-amine is sourced from PubChem (CID 106473321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).