N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide

C17H26N2OS — CID 90522920

IUPACN-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide
SMILESO=C(NC1CCCCCC1)N1CCC(c2ccsc2)CC1
InChIInChI=1S/C17H26N2OS/c20-17(18-16-5-3-1-2-4-6-16)19-10-7-14(8-11-19)15-9-12-21-13-15/h9,12-14,16H,1-8,10-11H2,(H,18,20)
InChIKeyNCFGGNANEHZOEC-UHFFFAOYSA-N
MW306.47 g/mol
LogP4.36
Rot. Bonds2

About N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide

N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide (PubChem CID 90522920) has the molecular formula C17H26N2OS and a molecular weight of 306.47 g/mol. Its IUPAC name is N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide
PubChem CID90522920
Molecular FormulaC17H26N2OS
Molecular Weight306.47 g/mol
Exact Mass306.18
IUPAC NameN-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide
SMILESO=C(NC1CCCCCC1)N1CCC(c2ccsc2)CC1
InChIInChI=1S/C17H26N2OS/c20-17(18-16-5-3-1-2-4-6-16)19-10-7-14(8-11-19)15-9-12-21-13-15/h9,12-14,16H,1-8,10-11H2,(H,18,20)
InChIKeyNCFGGNANEHZOEC-UHFFFAOYSA-N
XLogP4.36
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.47
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(oxan-4-yl)-3-thiophen-3-ylpyrrolidine-1-carboxamide
CID 131702845
N-cycloheptylpiperidine-1-carboxamide
CID 54054704
N-(2-methoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide
CID 90522512
(4-bromophenyl)-(4-thiophen-3-ylpiperidin-1-yl)methanone
CID 90522383
N-(2,4-dimethoxyphenyl)-4-thiophen-3-ylpiperidine-1-carboxamide
CID 90522522
N-cyclohexyl-4-(4-hydroxyphenyl)piperazine-1-carboxamide
CID 4169539
N-cyclohexyl-7-thiophen-2-yl-1,4-thiazepane-4-carboxamide
CID 90632960
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198
N-cyclopentylthiomorpholine-4-carboxamide
CID 115582925
N-cyclohexyl-4-phenylpiperazine-1-carboxamide
CID 858165
N-cycloheptyl-4-(hydroxymethyl)piperidine-1-carboxamide
CID 110894742
4-(cyclohexanecarbonylamino)-N-cyclohexylpiperidine-1-carboxamide
CID 3218389

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide?
The IUPAC name of N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide (CID 90522920) is N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide?
The canonical SMILES for N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide is O=C(NC1CCCCCC1)N1CCC(c2ccsc2)CC1.
What is the InChIKey of N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide?
The InChIKey is NCFGGNANEHZOEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2OS/c20-17(18-16-5-3-1-2-4-6-16)19-10-7-14(8-11-19)15-9-12-21-13-15/h9,12-14,16H,1-8,10-11H2,(H,18,20).
What are the key properties of N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide?
N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide has a molecular weight of 306.47 g/mol, XLogP of 4.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-4-thiophen-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 90522920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).