N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine

C17H17N3S — CID 82450331

IUPACN-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine
SMILESCNc1nc(-c2c3c(nc4ccc(C)cc24)CCC3)cs1
InChIInChI=1S/C17H17N3S/c1-10-6-7-14-12(8-10)16(11-4-3-5-13(11)19-14)15-9-21-17(18-2)20-15/h6-9H,3-5H2,1-2H3,(H,18,20)
InChIKeyDFANMGJPNJUAJM-UHFFFAOYSA-N
MW295.41 g/mol
LogP4.20
Rot. Bonds2

About N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine

N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine (PubChem CID 82450331) has the molecular formula C17H17N3S and a molecular weight of 295.41 g/mol. Its IUPAC name is N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine
PubChem CID82450331
Molecular FormulaC17H17N3S
Molecular Weight295.41 g/mol
Exact Mass295.11
IUPAC NameN-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine
SMILESCNc1nc(-c2c3c(nc4ccc(C)cc24)CCC3)cs1
InChIInChI=1S/C17H17N3S/c1-10-6-7-14-12(8-10)16(11-4-3-5-13(11)19-14)15-9-21-17(18-2)20-15/h6-9H,3-5H2,1-2H3,(H,18,20)
InChIKeyDFANMGJPNJUAJM-UHFFFAOYSA-N
XLogP4.20
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine with MolForge

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Related Compounds

5-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3,4-thiadiazol-2-amine
CID 82450327
4-(7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine
CID 82451450
4-methyl-3-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1H-1,2,4-triazole-5-thione
CID 82450325
N-methyl-4-(2,4,6-trimethylphenyl)-1,3-thiazol-2-amine
CID 60642187
4-(2,4-dimethylphenyl)-N-methyl-1,3-thiazol-2-amine
CID 17465165
N-[(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]ethanamine
CID 82450304
7-methyl-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbonitrile
CID 82450301
7-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
CID 752870
2-(7-methyl-1,2,3,4-tetrahydroacridin-9-yl)propan-2-ol
CID 82450358
N-[(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methyl]butan-2-amine
CID 82450310
2-methyl-N-propyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinolin-11-amine
CID 63479722
7-iodo-N-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62202165

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine (CID 82450331) is N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine is CNc1nc(-c2c3c(nc4ccc(C)cc24)CCC3)cs1.
What is the InChIKey of N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine?
The InChIKey is DFANMGJPNJUAJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3S/c1-10-6-7-14-12(8-10)16(11-4-3-5-13(11)19-14)15-9-21-17(18-2)20-15/h6-9H,3-5H2,1-2H3,(H,18,20).
What are the key properties of N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine?
N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine has a molecular weight of 295.41 g/mol, XLogP of 4.20, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 82450331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).