N-(2-adamantyl)thiophene-3-carboxamide

C15H19NOS — CID 24555583

IUPACN-(2-adamantyl)thiophene-3-carboxamide
SMILESO=C(NC1C2CC3CC(C2)CC1C3)c1ccsc1
InChIInChI=1S/C15H19NOS/c17-15(11-1-2-18-8-11)16-14-12-4-9-3-10(6-12)7-13(14)5-9/h1-2,8-10,12-14H,3-7H2,(H,16,17)
InChIKeyNFTOOLAIZCZFSN-UHFFFAOYSA-N
MW261.39 g/mol
LogP3.30
Rot. Bonds2

About N-(2-adamantyl)thiophene-3-carboxamide

N-(2-adamantyl)thiophene-3-carboxamide (PubChem CID 24555583) has the molecular formula C15H19NOS and a molecular weight of 261.39 g/mol. Its IUPAC name is N-(2-adamantyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-adamantyl)thiophene-3-carboxamide
PubChem CID24555583
Molecular FormulaC15H19NOS
Molecular Weight261.39 g/mol
Exact Mass261.12
IUPAC NameN-(2-adamantyl)thiophene-3-carboxamide
SMILESO=C(NC1C2CC3CC(C2)CC1C3)c1ccsc1
InChIInChI=1S/C15H19NOS/c17-15(11-1-2-18-8-11)16-14-12-4-9-3-10(6-12)7-13(14)5-9/h1-2,8-10,12-14H,3-7H2,(H,16,17)
InChIKeyNFTOOLAIZCZFSN-UHFFFAOYSA-N
XLogP3.30
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-azabicyclo[3.1.0]hexan-6-yl)thiophene-3-carboxamide
CID 43594331
N-(3-aminocyclobutyl)thiophene-3-carboxamide
CID 43594920
N-(2-adamantyl)-4-phenylbenzamide
CID 3608392
N-(azetidin-3-yl)thiophene-3-carboxamide
CID 66187231
N-[(3S,4R)-4-(thiophene-3-carbonylamino)oxolan-3-yl]thiophene-3-carboxamide
CID 138021648
N-[3-(hydroxymethyl)cyclobutyl]thiophene-3-carboxamide
CID 164653916
N-(2-adamantyl)-3-bromobenzamide
CID 771513
N-(2-adamantyl)-4-[4-[4-(2-adamantylcarbamoyl)phenoxy]-2,3,5,6-tetrafluorophenoxy]benzamide
CID 4244949
N-[(3S)-piperidin-3-yl]thiophene-3-carboxamide
CID 71645364
N-(6-amino-2-oxabicyclo[3.2.0]heptan-7-yl)thiophene-3-carboxamide
CID 66196694
N-(2-adamantyl)-2-aminobenzamide
CID 61214981
N-[(4aS,6R,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]dioxin-6-yl]thiophene-3-carboxamide
CID 124843923

Frequently Asked Questions

What is the IUPAC name of N-(2-adamantyl)thiophene-3-carboxamide?
The IUPAC name of N-(2-adamantyl)thiophene-3-carboxamide (CID 24555583) is N-(2-adamantyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(2-adamantyl)thiophene-3-carboxamide?
The canonical SMILES for N-(2-adamantyl)thiophene-3-carboxamide is O=C(NC1C2CC3CC(C2)CC1C3)c1ccsc1.
What is the InChIKey of N-(2-adamantyl)thiophene-3-carboxamide?
The InChIKey is NFTOOLAIZCZFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NOS/c17-15(11-1-2-18-8-11)16-14-12-4-9-3-10(6-12)7-13(14)5-9/h1-2,8-10,12-14H,3-7H2,(H,16,17).
What are the key properties of N-(2-adamantyl)thiophene-3-carboxamide?
N-(2-adamantyl)thiophene-3-carboxamide has a molecular weight of 261.39 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-adamantyl)thiophene-3-carboxamide is sourced from PubChem (CID 24555583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).