N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine

C16H18Cl2N2 — CID 82451593

IUPACN-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine
SMILESCC(C)NCc1c2c(nc3c(Cl)cc(Cl)cc13)CCC2
InChIInChI=1S/C16H18Cl2N2/c1-9(2)19-8-13-11-4-3-5-15(11)20-16-12(13)6-10(17)7-14(16)18/h6-7,9,19H,3-5,8H2,1-2H3
InChIKeyOPPOGLBOIFPBPS-UHFFFAOYSA-N
MW309.24 g/mol
LogP4.53
Rot. Bonds3

About N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine

N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine (PubChem CID 82451593) has the molecular formula C16H18Cl2N2 and a molecular weight of 309.24 g/mol. Its IUPAC name is N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine
PubChem CID82451593
Molecular FormulaC16H18Cl2N2
Molecular Weight309.24 g/mol
Exact Mass308.08
IUPAC NameN-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine
SMILESCC(C)NCc1c2c(nc3c(Cl)cc(Cl)cc13)CCC2
InChIInChI=1S/C16H18Cl2N2/c1-9(2)19-8-13-11-4-3-5-15(11)20-16-12(13)6-10(17)7-14(16)18/h6-7,9,19H,3-5,8H2,1-2H3
InChIKeyOPPOGLBOIFPBPS-UHFFFAOYSA-N
XLogP4.53
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.24
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62202722
5,7-dichloro-N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 63481227
2,4-dichloro-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63480718
N-[(5-methoxy-1,2,3,4-tetrahydroacridin-9-yl)methyl]propan-2-amine
CID 82451889
N-[(7-fluoro-1,2,3,4-tetrahydroacridin-9-yl)methyl]propan-2-amine
CID 82451463
2-(7-chloro-5-methyl-1,2,3,4-tetrahydroacridin-9-yl)acetonitrile
CID 82451782
5,9-dichloro-7-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline
CID 63409268
N-[(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]butan-2-amine
CID 82450310
7-chloro-5-iodo-N-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 107628867
7-chloro-5-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
CID 82451849
(6,8-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methanethiol
CID 82451652
N-[(5-propan-2-yl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine
CID 82450215

Frequently Asked Questions

What is the IUPAC name of N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine?
The IUPAC name of N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine (CID 82451593) is N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine is CC(C)NCc1c2c(nc3c(Cl)cc(Cl)cc13)CCC2.
What is the InChIKey of N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine?
The InChIKey is OPPOGLBOIFPBPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18Cl2N2/c1-9(2)19-8-13-11-4-3-5-15(11)20-16-12(13)6-10(17)7-14(16)18/h6-7,9,19H,3-5,8H2,1-2H3.
What are the key properties of N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine?
N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine has a molecular weight of 309.24 g/mol, XLogP of 4.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]propan-2-amine is sourced from PubChem (CID 82451593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).