N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride

C14H25Cl2N3O2S — CID 119896020

IUPACN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride
SMILESCCc1cnc(CCNC(=O)C2(OC)CCNCC2)s1.Cl.Cl
InChIInChI=1S/C14H23N3O2S.2ClH/c1-3-11-10-17-12(20-11)4-7-16-13(18)14(19-2)5-8-15-9-6-14;;/h10,15H,3-9H2,1-2H3,(H,16,18);2*1H
InChIKeyXAIXZFUSJSAKNL-UHFFFAOYSA-N
MW370.35 g/mol
LogP1.98
Rot. Bonds6

About N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride

N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride (PubChem CID 119896020) has the molecular formula C14H25Cl2N3O2S and a molecular weight of 370.35 g/mol. Its IUPAC name is N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride
PubChem CID119896020
Molecular FormulaC14H25Cl2N3O2S
Molecular Weight370.35 g/mol
Exact Mass369.10
IUPAC NameN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride
SMILESCCc1cnc(CCNC(=O)C2(OC)CCNCC2)s1.Cl.Cl
InChIInChI=1S/C14H23N3O2S.2ClH/c1-3-11-10-17-12(20-11)4-7-16-13(18)14(19-2)5-8-15-9-6-14;;/h10,15H,3-9H2,1-2H3,(H,16,18);2*1H
InChIKeyXAIXZFUSJSAKNL-UHFFFAOYSA-N
XLogP1.98
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.35
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119891778
N-[2-(5-bromothiophen-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119699598
4-methoxy-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide
CID 119861868
4-methoxy-N-(2-phenylethyl)piperidine-4-carboxamide;hydrochloride
CID 119670076
N-[2-(5-chloro-1,3-benzothiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119698375
N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111540672
N-[2-(3,4-diethoxyphenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119677415
(2R)-2-amino-N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]propanamide;dihydrochloride
CID 119896002
4-methoxy-N-pentylpiperidine-4-carboxamide
CID 119669674
N-[2-(2,6-difluorophenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119722583
2-(4-aminophenyl)-N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]acetamide;dihydrochloride
CID 119895978
1-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-3-(1-hydroxypropan-2-yl)urea
CID 71867691

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride?
The IUPAC name of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride (CID 119896020) is N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride.
What is the SMILES notation for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride?
The canonical SMILES for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride is CCc1cnc(CCNC(=O)C2(OC)CCNCC2)s1.Cl.Cl.
What is the InChIKey of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride?
The InChIKey is XAIXZFUSJSAKNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S.2ClH/c1-3-11-10-17-12(20-11)4-7-16-13(18)14(19-2)5-8-15-9-6-14;;/h10,15H,3-9H2,1-2H3,(H,16,18);2*1H.
What are the key properties of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride?
N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride has a molecular weight of 370.35 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]-4-methoxypiperidine-4-carboxamide;dihydrochloride is sourced from PubChem (CID 119896020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).