N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide

C12H17NOS — CID 51897806

IUPACN-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide
SMILESC[C@H](Cc1cccs1)NC(=O)C1CCC1
InChIInChI=1S/C12H17NOS/c1-9(8-11-6-3-7-15-11)13-12(14)10-4-2-5-10/h3,6-7,9-10H,2,4-5,8H2,1H3,(H,13,14)/t9-/m1/s1
InChIKeyYQHLGVIVFJEGCH-SECBINFHSA-N
MW223.34 g/mol
LogP2.60
Rot. Bonds4

About N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide

N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide (PubChem CID 51897806) has the molecular formula C12H17NOS and a molecular weight of 223.34 g/mol. Its IUPAC name is N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide.

Molecular Properties

Compound NameN-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide
PubChem CID51897806
Molecular FormulaC12H17NOS
Molecular Weight223.34 g/mol
Exact Mass223.10
IUPAC NameN-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide
SMILESC[C@H](Cc1cccs1)NC(=O)C1CCC1
InChIInChI=1S/C12H17NOS/c1-9(8-11-6-3-7-15-11)13-12(14)10-4-2-5-10/h3,6-7,9-10H,2,4-5,8H2,1H3,(H,13,14)/t9-/m1/s1
InChIKeyYQHLGVIVFJEGCH-SECBINFHSA-N
XLogP2.60
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.34
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,2R)-2-(1-thiophen-2-ylpropan-2-ylcarbamoyl)cyclopentane-1-carboxylic acid
CID 114091889
(3S)-3-N-[(2S)-1-thiophen-2-ylpropan-2-yl]piperidine-1,3-dicarboxamide
CID 32597617
(2S)-N-(1-thiophen-2-ylpropan-2-yl)pyrrolidine-2-carboxamide
CID 61178552
2-amino-N-(1-thiophen-2-ylpropan-2-yl)cyclohexane-1-carboxamide
CID 64824515
2-(propan-2-ylamino)-N-(1-thiophen-2-ylpropan-2-yl)acetamide
CID 60842186
3-bromo-N-(1-thiophen-2-ylpropan-2-yl)propanamide
CID 82110960
(1S,6R)-6-(1-thiophen-2-ylpropan-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
CID 104962113
(2S,5R)-5-(aminomethyl)-N-(1-thiophen-2-ylpropan-2-yl)oxolane-2-carboxamide
CID 120787356
cis-(1R,3S)-2,2-dimethyl-3-(1-thiophen-2-ylpropan-2-ylcarbamoyl)cyclopropane-1-carboxylic acid
CID 114091890
2-amino-2-cyclopropyl-N-(1-thiophen-2-ylpropan-2-yl)propanamide
CID 60866290
(2S)-1-(oxan-4-yl)-N-[(2S)-1-thiophen-2-ylpropan-2-yl]pyrrolidine-2-carboxamide
CID 124591408
3-hydroxy-N-(1-thiophen-2-ylpropan-2-yl)piperidine-1-carboxamide
CID 110896289

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide?
The IUPAC name of N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide (CID 51897806) is N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide.
What is the SMILES notation for N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide?
The canonical SMILES for N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide is C[C@H](Cc1cccs1)NC(=O)C1CCC1.
What is the InChIKey of N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide?
The InChIKey is YQHLGVIVFJEGCH-SECBINFHSA-N. The full InChI is InChI=1S/C12H17NOS/c1-9(8-11-6-3-7-15-11)13-12(14)10-4-2-5-10/h3,6-7,9-10H,2,4-5,8H2,1H3,(H,13,14)/t9-/m1/s1.
What are the key properties of N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide?
N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide has a molecular weight of 223.34 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-thiophen-2-ylpropan-2-yl]cyclobutanecarboxamide is sourced from PubChem (CID 51897806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).