N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride

C16H19ClN2OS — CID 119288849

IUPACN-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NCCc1cccc2ccccc12)C1CSCN1
InChIInChI=1S/C16H18N2OS.ClH/c19-16(15-10-20-11-18-15)17-9-8-13-6-3-5-12-4-1-2-7-14(12)13;/h1-7,15,18H,8-11H2,(H,17,19);1H
InChIKeyWSGFMGUOCJQJKK-UHFFFAOYSA-N
MW322.86 g/mol
LogP2.58
Rot. Bonds4

About N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride

N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119288849) has the molecular formula C16H19ClN2OS and a molecular weight of 322.86 g/mol. Its IUPAC name is N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119288849
Molecular FormulaC16H19ClN2OS
Molecular Weight322.86 g/mol
Exact Mass322.09
IUPAC NameN-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NCCc1cccc2ccccc12)C1CSCN1
InChIInChI=1S/C16H18N2OS.ClH/c19-16(15-10-20-11-18-15)17-9-8-13-6-3-5-12-4-1-2-7-14(12)13;/h1-7,15,18H,8-11H2,(H,17,19);1H
InChIKeyWSGFMGUOCJQJKK-UHFFFAOYSA-N
XLogP2.58
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.86
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-hydroxyphenyl)ethyl]-1,3-thiazolidine-4-carboxamide
CID 110672368
N-(2-naphthalen-1-ylethyl)piperidine-2-carboxamide;hydrochloride
CID 119288851
N-[2-(1-benzofuran-2-yl)ethyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119332483
N-[2-(4-oxo-3H-quinazolin-2-yl)ethyl]-1,3-thiazolidine-4-carboxamide
CID 136811645
N-[3-(benzylamino)-3-oxopropyl]-1,3-thiazolidine-4-carboxamide
CID 119310941
N-benzyl-1,3-thiazolidine-4-carboxamide
CID 24693076
N-[2-(4-fluoro-2-methylphenyl)ethyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119341073
(4R)-N-[(2-ethylphenyl)methyl]-1,3-thiazolidine-4-carboxamide
CID 141124535
N-(2-naphthalen-1-ylethyl)cyclohexanecarboxamide
CID 19963481
N-[2-(2,6-dimethylphenoxy)ethyl]-1,3-thiazolidine-4-carboxamide
CID 119295663
N-[2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119326179
N-[(2,3-dimethoxyphenyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119281335

Frequently Asked Questions

What is the IUPAC name of N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119288849) is N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is Cl.O=C(NCCc1cccc2ccccc12)C1CSCN1.
What is the InChIKey of N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is WSGFMGUOCJQJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2OS.ClH/c19-16(15-10-20-11-18-15)17-9-8-13-6-3-5-12-4-1-2-7-14(12)13;/h1-7,15,18H,8-11H2,(H,17,19);1H.
What are the key properties of N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride?
N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 322.86 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-naphthalen-1-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119288849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).