(2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide

C14H14ClN3O2S — CID 97350829

IUPAC(2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide
SMILESNC(=O)[C@H]1CN(c2nc(-c3ccccc3Cl)cs2)CCO1
InChIInChI=1S/C14H14ClN3O2S/c15-10-4-2-1-3-9(10)11-8-21-14(17-11)18-5-6-20-12(7-18)13(16)19/h1-4,8,12H,5-7H2,(H2,16,19)/t12-/m1/s1
InChIKeyGSENFZOTPSNDKH-GFCCVEGCSA-N
MW323.81 g/mol
LogP2.15
Rot. Bonds3

About (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide

(2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide (PubChem CID 97350829) has the molecular formula C14H14ClN3O2S and a molecular weight of 323.81 g/mol. Its IUPAC name is (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide
PubChem CID97350829
Molecular FormulaC14H14ClN3O2S
Molecular Weight323.81 g/mol
Exact Mass323.05
IUPAC Name(2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide
SMILESNC(=O)[C@H]1CN(c2nc(-c3ccccc3Cl)cs2)CCO1
InChIInChI=1S/C14H14ClN3O2S/c15-10-4-2-1-3-9(10)11-8-21-14(17-11)18-5-6-20-12(7-18)13(16)19/h1-4,8,12H,5-7H2,(H2,16,19)/t12-/m1/s1
InChIKeyGSENFZOTPSNDKH-GFCCVEGCSA-N
XLogP2.15
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.81
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]piperazine-1-carboxylic acid
CID 68778558
1-(4-naphthalen-1-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 630762
1-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 623279
methyl 2-[4-(4-phenyl-1,3-thiazol-2-yl)morpholin-2-yl]acetate
CID 154750161
(2R)-4-[2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]acetyl]morpholine-2-carboxylic acid
CID 124704017
1-[4-[2-(hydroxyamino)phenyl]-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 123534585
4-(2-chlorophenyl)-1,3-thiazole-2-carboxamide
CID 19375958
1-(4-phenyl-1,3-thiazol-2-yl)piperidine-3-carboxamide
CID 4208594
1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 46907682
2-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-1,3-thiazole-4-carboxamide
CID 95539381
[1-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-3-methylpiperidin-3-yl]methanol
CID 133451629
4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-2-morpholin-4-ylpyrimidine-5-carboxamide
CID 162386847

Frequently Asked Questions

What is the IUPAC name of (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide?
The IUPAC name of (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide (CID 97350829) is (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide.
What is the SMILES notation for (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide?
The canonical SMILES for (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide is NC(=O)[C@H]1CN(c2nc(-c3ccccc3Cl)cs2)CCO1.
What is the InChIKey of (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide?
The InChIKey is GSENFZOTPSNDKH-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H14ClN3O2S/c15-10-4-2-1-3-9(10)11-8-21-14(17-11)18-5-6-20-12(7-18)13(16)19/h1-4,8,12H,5-7H2,(H2,16,19)/t12-/m1/s1.
What are the key properties of (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide?
(2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide has a molecular weight of 323.81 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]morpholine-2-carboxamide is sourced from PubChem (CID 97350829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).