4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride

C13H23Cl2N3O2S — CID 119859315

IUPAC4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride
SMILESCOC1(C(=O)N(C)Cc2cnc(C)s2)CCNCC1.Cl.Cl
InChIInChI=1S/C13H21N3O2S.2ClH/c1-10-15-8-11(19-10)9-16(2)12(17)13(18-3)4-6-14-7-5-13;;/h8,14H,4-7,9H2,1-3H3;2*1H
InChIKeyHDCSVKBLCGJXQA-UHFFFAOYSA-N
MW356.32 g/mol
LogP2.02
Rot. Bonds4

About 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride

4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride (PubChem CID 119859315) has the molecular formula C13H23Cl2N3O2S and a molecular weight of 356.32 g/mol. Its IUPAC name is 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound Name4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride
PubChem CID119859315
Molecular FormulaC13H23Cl2N3O2S
Molecular Weight356.32 g/mol
Exact Mass355.09
IUPAC Name4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride
SMILESCOC1(C(=O)N(C)Cc2cnc(C)s2)CCNCC1.Cl.Cl
InChIInChI=1S/C13H21N3O2S.2ClH/c1-10-15-8-11(19-10)9-16(2)12(17)13(18-3)4-6-14-7-5-13;;/h8,14H,4-7,9H2,1-3H3;2*1H
InChIKeyHDCSVKBLCGJXQA-UHFFFAOYSA-N
XLogP2.02
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.32
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride with MolForge

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Related Compounds

N-[(5-bromothiophen-2-yl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide
CID 119688975
4-methoxy-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide
CID 119861868
N-methyl-1-methylsulfonyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopropane-1-carboxamide
CID 146083931
4-methoxy-N-methyl-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide
CID 119681705
N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide
CID 119681307
2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide
CID 82763796
N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-piperidin-4-ylpropanamide
CID 62212128
(2S)-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119859306
4-methoxy-N-methyl-N-(2-methylpropyl)piperidine-4-carboxamide;hydrochloride
CID 119708518
4-(methoxymethyl)-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride
CID 120645205
N-(1-adamantylmethyl)-4-methoxy-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119730855
(2S)-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-2-carboxamide;dihydrochloride
CID 119859299

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride?
The IUPAC name of 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride (CID 119859315) is 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride.
What is the SMILES notation for 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride?
The canonical SMILES for 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride is COC1(C(=O)N(C)Cc2cnc(C)s2)CCNCC1.Cl.Cl.
What is the InChIKey of 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride?
The InChIKey is HDCSVKBLCGJXQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S.2ClH/c1-10-15-8-11(19-10)9-16(2)12(17)13(18-3)4-6-14-7-5-13;;/h8,14H,4-7,9H2,1-3H3;2*1H.
What are the key properties of 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride?
4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride has a molecular weight of 356.32 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 119859315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).