N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride

C11H21ClN2O2S — CID 119330198

IUPACN-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CCCCC1O)C1CSCN1
InChIInChI=1S/C11H20N2O2S.ClH/c14-10-4-2-1-3-8(10)5-12-11(15)9-6-16-7-13-9;/h8-10,13-14H,1-7H2,(H,12,15);1H
InChIKeySZFAJADKWIPJLP-UHFFFAOYSA-N
MW280.82 g/mol
LogP0.74
Rot. Bonds3

About N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride

N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride (PubChem CID 119330198) has the molecular formula C11H21ClN2O2S and a molecular weight of 280.82 g/mol. Its IUPAC name is N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
PubChem CID119330198
Molecular FormulaC11H21ClN2O2S
Molecular Weight280.82 g/mol
Exact Mass280.10
IUPAC NameN-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
SMILESCl.O=C(NCC1CCCCC1O)C1CSCN1
InChIInChI=1S/C11H20N2O2S.ClH/c14-10-4-2-1-3-8(10)5-12-11(15)9-6-16-7-13-9;/h8-10,13-14H,1-7H2,(H,12,15);1H
InChIKeySZFAJADKWIPJLP-UHFFFAOYSA-N
XLogP0.74
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.82
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride 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

N-[(2-hydroxycyclopentyl)methyl]piperidine-2-carboxamide;hydrochloride
CID 111463943
N-[[2-(methanesulfonamido)cyclopentyl]methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119345210
N-(oxan-2-ylmethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 91659376
N-(2-bicyclo[2.2.1]heptanylmethyl)-1,3-thiazolidine-4-carboxamide
CID 63683998
N-(2-hydroxycyclohexyl)-1,3-thiazolidine-4-carboxamide
CID 62359079
N-[(2-hydroxycyclohexyl)methyl]thiolane-3-carboxamide
CID 64911749
N-[(2-hydroxycyclohexyl)methyl]cyclopentanecarboxamide
CID 64928899
(4S)-N-(2-acetamidoethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119268318
(4S)-N-(oxan-4-ylmethyl)-1,3-thiazolidine-4-carboxamide
CID 119290243
N-(4-cyclopentylbutyl)-1,3-thiazolidine-4-carboxamide
CID 119327705
N-[2-[cyclopentyl(methyl)amino]ethyl]-1,3-thiazolidine-4-carboxamide;dihydrochloride
CID 119878784
2-[[(4R)-1,3-thiazolidine-4-carbonyl](15N)amino]acetic acid
CID 171381409

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride?
The IUPAC name of N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride (CID 119330198) is N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride is Cl.O=C(NCC1CCCCC1O)C1CSCN1.
What is the InChIKey of N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride?
The InChIKey is SZFAJADKWIPJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O2S.ClH/c14-10-4-2-1-3-8(10)5-12-11(15)9-6-16-7-13-9;/h8-10,13-14H,1-7H2,(H,12,15);1H.
What are the key properties of N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride?
N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride has a molecular weight of 280.82 g/mol, XLogP of 0.74, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxycyclohexyl)methyl]-1,3-thiazolidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119330198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).