N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine

C19H21N3S — CID 53272756

IUPACN-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine
SMILESc1ccc2c(-c3cnc(CNN4CCCCC4)s3)cccc2c1
InChIInChI=1S/C19H21N3S/c1-4-11-22(12-5-1)21-14-19-20-13-18(23-19)17-10-6-8-15-7-2-3-9-16(15)17/h2-3,6-10,13,21H,1,4-5,11-12,14H2
InChIKeyBGYXFTKDRGJFSU-UHFFFAOYSA-N
MW323.46 g/mol
LogP4.45
Rot. Bonds4

About N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine

N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine (PubChem CID 53272756) has the molecular formula C19H21N3S and a molecular weight of 323.46 g/mol. Its IUPAC name is N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine.

Molecular Properties

Compound NameN-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine
PubChem CID53272756
Molecular FormulaC19H21N3S
Molecular Weight323.46 g/mol
Exact Mass323.15
IUPAC NameN-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine
SMILESc1ccc2c(-c3cnc(CNN4CCCCC4)s3)cccc2c1
InChIInChI=1S/C19H21N3S/c1-4-11-22(12-5-1)21-14-19-20-13-18(23-19)17-10-6-8-15-7-2-3-9-16(15)17/h2-3,6-10,13,21H,1,4-5,11-12,14H2
InChIKeyBGYXFTKDRGJFSU-UHFFFAOYSA-N
XLogP4.45
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.46
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-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-(3-Phenylphenyl)-1,3-thiazol-2-yl]methanamine
CID 155557978
2-Methyl-5-naphthalen-2-yl-1,3-thiazole
CID 2803069
5-(8-Fluoronaphthalen-1-yl)-2-propan-2-yl-1,3-thiazole
CID 169968837
2-Methyl-5-naphthalen-2-yl-1,3-thiazole;hydrobromide
CID 2803068
2-Methyl-5-(1-naphthalenyl)thiazole
CID 162409018
N-[[5-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]-4-methylpiperazin-1-amine
CID 53272261
N-[[5-(4-fluorophenyl)-1,3-thiazol-2-yl]methyl]piperidin-1-amine
CID 53272262
2-[[5-(4-Fluorophenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine
CID 53272272
N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]-4-methylpiperazin-1-amine
CID 53272282
N-[[5-(2-fluorophenyl)-1,3-thiazol-2-yl]methyl]piperidin-1-amine
CID 53272283
2-[[5-(2-Fluorophenyl)-1,3-thiazol-2-yl]methyl]-1,1-dimethylhydrazine
CID 53272292
2-(3-fluorophenyl)-N-[[5-(3-methylphenyl)-1,3-thiazol-2-yl]methyl]ethanamine
CID 53272511

Frequently Asked Questions

What is the IUPAC name of N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine?
The IUPAC name of N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine (CID 53272756) is N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine.
What is the SMILES notation for N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine?
The canonical SMILES for N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine is c1ccc2c(-c3cnc(CNN4CCCCC4)s3)cccc2c1.
What is the InChIKey of N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine?
The InChIKey is BGYXFTKDRGJFSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3S/c1-4-11-22(12-5-1)21-14-19-20-13-18(23-19)17-10-6-8-15-7-2-3-9-16(15)17/h2-3,6-10,13,21H,1,4-5,11-12,14H2.
What are the key properties of N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine?
N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine has a molecular weight of 323.46 g/mol, XLogP of 4.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-naphthalen-1-yl-1,3-thiazol-2-yl)methyl]piperidin-1-amine is sourced from PubChem (CID 53272756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).