5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride

C17H26ClN3O2S — CID 119309715

IUPAC5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride
SMILESCc1ccc(C(=O)NC2CCN(C(=O)C3CCCNC3)CC2)s1.Cl
InChIInChI=1S/C17H25N3O2S.ClH/c1-12-4-5-15(23-12)16(21)19-14-6-9-20(10-7-14)17(22)13-3-2-8-18-11-13;/h4-5,13-14,18H,2-3,6-11H2,1H3,(H,19,21);1H
InChIKeyARXGLIUCSBZYAP-UHFFFAOYSA-N
MW371.93 g/mol
LogP2.20
Rot. Bonds3

About 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride

5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride (PubChem CID 119309715) has the molecular formula C17H26ClN3O2S and a molecular weight of 371.93 g/mol. Its IUPAC name is 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride.

Molecular Properties

Compound Name5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride
PubChem CID119309715
Molecular FormulaC17H26ClN3O2S
Molecular Weight371.93 g/mol
Exact Mass371.14
IUPAC Name5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride
SMILESCc1ccc(C(=O)NC2CCN(C(=O)C3CCCNC3)CC2)s1.Cl
InChIInChI=1S/C17H25N3O2S.ClH/c1-12-4-5-15(23-12)16(21)19-14-6-9-20(10-7-14)17(22)13-3-2-8-18-11-13;/h4-5,13-14,18H,2-3,6-11H2,1H3,(H,19,21);1H
InChIKeyARXGLIUCSBZYAP-UHFFFAOYSA-N
XLogP2.20
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.93
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 119745421
N-[1-(2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl)piperidin-4-yl]-5-methylthiophene-2-carboxamide;hydrochloride
CID 119309691
N-[1-(piperidine-3-carbonyl)piperidin-4-yl]cyclopropanecarboxamide;hydrochloride
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N-[1-[(3R)-piperidine-3-carbonyl]piperidin-4-yl]cyclopropanecarboxamide
CID 81129562
5-chloro-N-[1-(cyclohexanecarbonyl)piperidin-4-yl]thiophene-2-carboxamide
CID 55690906
5-[4-[(5-methylthiophene-2-carbonyl)amino]piperidine-1-carbonyl]pyrazine-2-carboxylic acid
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N-[1-(4-aminobutanoyl)piperidin-4-yl]-5-methylthiophene-2-carboxamide;hydrochloride
CID 119309719
5-methyl-N-[1-(2-thiomorpholin-3-ylacetyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride
CID 119938169
N-[1-(1,5-dimethylpyrrole-2-carbonyl)piperidin-4-yl]-5-methylthiophene-2-carboxamide
CID 49414960
5-cyclopropyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]-1,2-oxazole-3-carboxamide
CID 145040372
5-methyl-N-[1-(2-thiophen-3-ylacetyl)piperidin-4-yl]thiophene-2-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride?
The IUPAC name of 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride (CID 119309715) is 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride.
What is the SMILES notation for 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride?
The canonical SMILES for 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride is Cc1ccc(C(=O)NC2CCN(C(=O)C3CCCNC3)CC2)s1.Cl.
What is the InChIKey of 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride?
The InChIKey is ARXGLIUCSBZYAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2S.ClH/c1-12-4-5-15(23-12)16(21)19-14-6-9-20(10-7-14)17(22)13-3-2-8-18-11-13;/h4-5,13-14,18H,2-3,6-11H2,1H3,(H,19,21);1H.
What are the key properties of 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride?
5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride has a molecular weight of 371.93 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[1-(piperidine-3-carbonyl)piperidin-4-yl]thiophene-2-carboxamide;hydrochloride is sourced from PubChem (CID 119309715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).