1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine

C18H18N2S — CID 61331562

IUPAC1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine
SMILESCNC(c1ccc2ccccc2c1)c1nc2c(s1)CCC2
InChIInChI=1S/C18H18N2S/c1-19-17(18-20-15-7-4-8-16(15)21-18)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11,17,19H,4,7-8H2,1H3
InChIKeyBNOWSKPVGPPCPL-UHFFFAOYSA-N
MW294.42 g/mol
LogP4.09
Rot. Bonds3

About 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine

1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine (PubChem CID 61331562) has the molecular formula C18H18N2S and a molecular weight of 294.42 g/mol. Its IUPAC name is 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine.

Molecular Properties

Compound Name1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine
PubChem CID61331562
Molecular FormulaC18H18N2S
Molecular Weight294.42 g/mol
Exact Mass294.12
IUPAC Name1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine
SMILESCNC(c1ccc2ccccc2c1)c1nc2c(s1)CCC2
InChIInChI=1S/C18H18N2S/c1-19-17(18-20-15-7-4-8-16(15)21-18)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11,17,19H,4,7-8H2,1H3
InChIKeyBNOWSKPVGPPCPL-UHFFFAOYSA-N
XLogP4.09
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine with MolForge

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Related Compounds

2-[(E)-1-(4-methyl-2-naphthalen-2-yl-1,3-thiazol-5-yl)ethylideneamino]guanidine
CID 74221279
US11608337, Example 1
CID 132085793
1-(2,4-difluorophenyl)-N-[1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]ethanamine
CID 75395422
2-(8-Fluoro-4,5-dimethylnaphthalen-2-yl)-4-methyl-5-pent-1-en-2-yl-1,3-thiazole
CID 134301697
2-(8-Fluoro-4,7-dimethylnaphthalen-2-yl)-4-methyl-5-pent-1-en-2-yl-1,3-thiazole
CID 134301718
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 55244805
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-(4-fluorophenyl)-N-methylmethanamine
CID 61329984
5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl-[4-(trifluoromethyl)phenyl]methanamine
CID 61330100
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-1-(3-fluorophenyl)-N-methylmethanamine
CID 61330374
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-[3-(trifluoromethyl)phenyl]methanamine
CID 61330377
1-(2,6-difluorophenyl)-1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methylmethanamine
CID 61330773
1-(3,4-difluorophenyl)-1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methylmethanamine
CID 61330774

Frequently Asked Questions

What is the IUPAC name of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine?
The IUPAC name of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine (CID 61331562) is 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine.
What is the SMILES notation for 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine?
The canonical SMILES for 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine is CNC(c1ccc2ccccc2c1)c1nc2c(s1)CCC2.
What is the InChIKey of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine?
The InChIKey is BNOWSKPVGPPCPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2S/c1-19-17(18-20-15-7-4-8-16(15)21-18)14-10-9-12-5-2-3-6-13(12)11-14/h2-3,5-6,9-11,17,19H,4,7-8H2,1H3.
What are the key properties of 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine?
1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine has a molecular weight of 294.42 g/mol, XLogP of 4.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-N-methyl-1-naphthalen-2-ylmethanamine is sourced from PubChem (CID 61331562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).