N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride

C15H20ClN3O2S2 — CID 119696616

IUPACN-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride
SMILESCc1nc(-c2ccc(CCNC(=O)C3CNCCO3)s2)cs1.Cl
InChIInChI=1S/C15H19N3O2S2.ClH/c1-10-18-12(9-21-10)14-3-2-11(22-14)4-5-17-15(19)13-8-16-6-7-20-13;/h2-3,9,13,16H,4-8H2,1H3,(H,17,19);1H
InChIKeyBPOQRIGHRLHFQQ-UHFFFAOYSA-N
MW373.93 g/mol
LogP2.25
Rot. Bonds5

About N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride

N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119696616) has the molecular formula C15H20ClN3O2S2 and a molecular weight of 373.93 g/mol. Its IUPAC name is N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119696616
Molecular FormulaC15H20ClN3O2S2
Molecular Weight373.93 g/mol
Exact Mass373.07
IUPAC NameN-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride
SMILESCc1nc(-c2ccc(CCNC(=O)C3CNCCO3)s2)cs1.Cl
InChIInChI=1S/C15H19N3O2S2.ClH/c1-10-18-12(9-21-10)14-3-2-11(22-14)4-5-17-15(19)13-8-16-6-7-20-13;/h2-3,9,13,16H,4-8H2,1H3,(H,17,19);1H
InChIKeyBPOQRIGHRLHFQQ-UHFFFAOYSA-N
XLogP2.25
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.93
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride with MolForge

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Related Compounds

N-[2-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]ethyl]morpholine-2-carboxamide;dihydrochloride
CID 119837229
(2S,5R)-5-(aminomethyl)-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]oxolane-2-carboxamide
CID 120784952
2-amino-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]acetamide;hydrochloride
CID 119275088
1-acetyl-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]piperidine-4-carboxamide
CID 18120375
2-methoxy-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]acetamide
CID 47014812
3-amino-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]cyclohexane-1-carboxamide
CID 119696591
2-(methylamino)-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]acetamide
CID 119696595
(2S)-2-amino-3,3-dimethyl-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]butanamide
CID 119696599
2-methyl-3-(methylamino)-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]propanamide;hydrochloride
CID 119696604
3,5-dimethyl-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]benzamide
CID 27294304
2-amino-3-methyl-N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]pentanamide;hydrochloride
CID 119696612
N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]morpholine-2-carboxamide
CID 106416037

Frequently Asked Questions

What is the IUPAC name of N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride (CID 119696616) is N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride is Cc1nc(-c2ccc(CCNC(=O)C3CNCCO3)s2)cs1.Cl.
What is the InChIKey of N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is BPOQRIGHRLHFQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S2.ClH/c1-10-18-12(9-21-10)14-3-2-11(22-14)4-5-17-15(19)13-8-16-6-7-20-13;/h2-3,9,13,16H,4-8H2,1H3,(H,17,19);1H.
What are the key properties of N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride?
N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 373.93 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119696616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).