N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride

C16H20ClN3O2S — CID 119778931

IUPACN-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
SMILESCC(NC(=O)C1COCCN1)c1nc(-c2ccccc2)cs1.Cl
InChIInChI=1S/C16H19N3O2S.ClH/c1-11(18-15(20)13-9-21-8-7-17-13)16-19-14(10-22-16)12-5-3-2-4-6-12;/h2-6,10-11,13,17H,7-9H2,1H3,(H,18,20);1H
InChIKeyAWKSYSHQBIXQDR-UHFFFAOYSA-N
MW353.88 g/mol
LogP2.40
Rot. Bonds4

About N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride

N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119778931) has the molecular formula C16H20ClN3O2S and a molecular weight of 353.88 g/mol. Its IUPAC name is N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
PubChem CID119778931
Molecular FormulaC16H20ClN3O2S
Molecular Weight353.88 g/mol
Exact Mass353.10
IUPAC NameN-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
SMILESCC(NC(=O)C1COCCN1)c1nc(-c2ccccc2)cs1.Cl
InChIInChI=1S/C16H19N3O2S.ClH/c1-11(18-15(20)13-9-21-8-7-17-13)16-19-14(10-22-16)12-5-3-2-4-6-12;/h2-6,10-11,13,17H,7-9H2,1H3,(H,18,20);1H
InChIKeyAWKSYSHQBIXQDR-UHFFFAOYSA-N
XLogP2.40
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.88
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-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-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]piperidine-2-carboxamide
CID 119320857
(3R)-N-[(1S)-1-phenylethyl]morpholine-3-carboxamide
CID 16681349
4-[1-(4-phenyl-1,3-thiazol-2-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120673541
2-[1-(4-phenyl-1,3-thiazol-2-yl)ethylcarbamoyl]cyclopropane-1-carboxylic acid
CID 119184553
N-[1-(2-methylphenyl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119686030
N-[1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]ethyl]piperidine-2-carboxamide
CID 119340374
N-[1-(1-benzofuran-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride
CID 119691689
N-[1-[4-methyl-2-(4-methylphenyl)-1,3-thiazol-5-yl]ethyl]morpholine-3-carboxamide;hydrochloride
CID 119779753
2-(cyclopropylmethylamino)-N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 119778952
N-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]morpholine-3-carboxamide;hydrochloride
CID 119689444
3-amino-2-methyl-N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]butanamide
CID 120500624
N-[1-(benzylamino)-1-oxopropan-2-yl]morpholine-3-carboxamide;hydrochloride
CID 119750954

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride (CID 119778931) is N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride is CC(NC(=O)C1COCCN1)c1nc(-c2ccccc2)cs1.Cl.
What is the InChIKey of N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride?
The InChIKey is AWKSYSHQBIXQDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2S.ClH/c1-11(18-15(20)13-9-21-8-7-17-13)16-19-14(10-22-16)12-5-3-2-4-6-12;/h2-6,10-11,13,17H,7-9H2,1H3,(H,18,20);1H.
What are the key properties of N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride?
N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 353.88 g/mol, XLogP of 2.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-phenyl-1,3-thiazol-2-yl)ethyl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119778931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).