5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide

C17H25ClN2OS — CID 25161511

IUPAC5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide
SMILESO=C(NCC1(N2CCCCC2)CCCCC1)c1ccc(Cl)s1
InChIInChI=1S/C17H25ClN2OS/c18-15-8-7-14(22-15)16(21)19-13-17(9-3-1-4-10-17)20-11-5-2-6-12-20/h7-8H,1-6,9-13H2,(H,19,21)
InChIKeyRAHQQVSVPKPCFN-UHFFFAOYSA-N
MW340.92 g/mol
LogP4.32
Rot. Bonds4

About 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide

5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide (PubChem CID 25161511) has the molecular formula C17H25ClN2OS and a molecular weight of 340.92 g/mol. Its IUPAC name is 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide
PubChem CID25161511
Molecular FormulaC17H25ClN2OS
Molecular Weight340.92 g/mol
Exact Mass340.14
IUPAC Name5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide
SMILESO=C(NCC1(N2CCCCC2)CCCCC1)c1ccc(Cl)s1
InChIInChI=1S/C17H25ClN2OS/c18-15-8-7-14(22-15)16(21)19-13-17(9-3-1-4-10-17)20-11-5-2-6-12-20/h7-8H,1-6,9-13H2,(H,19,21)
InChIKeyRAHQQVSVPKPCFN-UHFFFAOYSA-N
XLogP4.32
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.92
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-[(1-morpholin-4-ylcyclohexyl)methyl]thiophene-2-carboxamide
CID 30255015
5-chloro-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide
CID 25237516
4-piperidin-1-yl-N-[(1-pyrrolidin-1-ylcyclopentyl)methyl]benzamide
CID 91760256
2-chloro-5-methylsulfonyl-N-[(1-piperidin-1-ylcyclohexyl)methyl]benzamide
CID 17478468
N-[2-chloro-5-[(1-piperidin-1-ylcyclohexyl)methylcarbamoyl]phenyl]thiophene-2-carboxamide
CID 26560125
5-chloro-N-[[(2S)-2-hydroxy-3,4-dihydro-1H-naphthalen-2-yl]methyl]thiophene-2-carboxamide
CID 97042595
5-chloro-N-[(6-hydroxy-1,4-dithiepan-6-yl)methyl]thiophene-2-carboxamide
CID 146080055
N-[(1-morpholin-4-ylcyclohexyl)methyl]-1-benzothiophene-2-carboxamide
CID 46512703
N-[(1-piperidin-1-ylcyclohexyl)methyl]pyrazine-2-carboxamide
CID 17447495
N-[[1-(4-ethylpiperazin-1-yl)cyclohexyl]methyl]thiophene-2-carboxamide
CID 35672039
1-oxido-N-[(1-piperidin-1-ylcyclohexyl)methyl]pyridin-1-ium-2-carboxamide
CID 51116095
4-morpholin-4-yl-N-[(1-pyrrolidin-1-ylcyclohexyl)methyl]benzamide
CID 91792119

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide (CID 25161511) is 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide is O=C(NCC1(N2CCCCC2)CCCCC1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide?
The InChIKey is RAHQQVSVPKPCFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25ClN2OS/c18-15-8-7-14(22-15)16(21)19-13-17(9-3-1-4-10-17)20-11-5-2-6-12-20/h7-8H,1-6,9-13H2,(H,19,21).
What are the key properties of 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide?
5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide has a molecular weight of 340.92 g/mol, XLogP of 4.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[(1-piperidin-1-ylcyclohexyl)methyl]thiophene-2-carboxamide is sourced from PubChem (CID 25161511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).