N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide

C15H22N2OS — CID 6473714

IUPACN-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide
SMILESO=C(NC1CCCCCC1)c1csc2c1CCNC2
InChIInChI=1S/C15H22N2OS/c18-15(17-11-5-3-1-2-4-6-11)13-10-19-14-9-16-8-7-12(13)14/h10-11,16H,1-9H2,(H,17,18)
InChIKeyMCZYMVYCKBCWHS-UHFFFAOYSA-N
MW278.42 g/mol
LogP2.85
Rot. Bonds2

About N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide

N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide (PubChem CID 6473714) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide
PubChem CID6473714
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC NameN-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide
SMILESO=C(NC1CCCCCC1)c1csc2c1CCNC2
InChIInChI=1S/C15H22N2OS/c18-15(17-11-5-3-1-2-4-6-11)13-10-19-14-9-16-8-7-12(13)14/h10-11,16H,1-9H2,(H,17,18)
InChIKeyMCZYMVYCKBCWHS-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-1,2,3,4-tetrahydroisoquinoline-5-carboxamide
CID 104557993
N-cyclohexyl-5,6,7,8-tetrahydro-2,7-naphthyridine-4-carboxamide
CID 112520196
N-(4-hydroxycyclohexyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 43389642
N-cyclohexyl-4,5,6,7-tetrahydrothieno[3,2-c]pyridine-2-carboxamide;hydrobromide
CID 138111140
N-(1-methylsulfonylpiperidin-4-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 39999740
N-[(Z)-3-amino-4,4-dimethylpent-2-enoyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide
CID 165143044
N-(3,3-dimethylcyclopentyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 114550378
N-(1,1-dioxothiolan-3-yl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 17484645
N-[(1S,2S,3R)-2,3-dimethylcyclohexyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
CID 98465292
N-phenyl-4-(4,5,6,7-tetrahydro-1-benzothiophene-3-carbonylamino)piperidine-1-carboxamide
CID 51324355
N-cyclohexyl-3-oxo-4,5,6,7-tetrahydro-[1,2]oxazolo[5,4-c]pyridine-2-carboxamide
CID 12851775
2-chloro-N-cycloheptylbenzamide;pyrrolidine
CID 143233402

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide?
The IUPAC name of N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide (CID 6473714) is N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide.
What is the SMILES notation for N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide?
The canonical SMILES for N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide is O=C(NC1CCCCCC1)c1csc2c1CCNC2.
What is the InChIKey of N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide?
The InChIKey is MCZYMVYCKBCWHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c18-15(17-11-5-3-1-2-4-6-11)13-10-19-14-9-16-8-7-12(13)14/h10-11,16H,1-9H2,(H,17,18).
What are the key properties of N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide?
N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide has a molecular weight of 278.42 g/mol, XLogP of 2.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 6473714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).