N-propan-2-ylcyclobutene-1-carboxamide

C8H13NO — CID 126994401

IUPACN-propan-2-ylcyclobutene-1-carboxamide
SMILESCC(C)NC(=O)C1=CCC1
InChIInChI=1S/C8H13NO/c1-6(2)9-8(10)7-4-3-5-7/h4,6H,3,5H2,1-2H3,(H,9,10)
InChIKeyUNVOAZPYCBSWFG-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.23
Rot. Bonds2

About N-propan-2-ylcyclobutene-1-carboxamide

N-propan-2-ylcyclobutene-1-carboxamide (PubChem CID 126994401) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is N-propan-2-ylcyclobutene-1-carboxamide.

Molecular Properties

Compound NameN-propan-2-ylcyclobutene-1-carboxamide
PubChem CID126994401
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC NameN-propan-2-ylcyclobutene-1-carboxamide
SMILESCC(C)NC(=O)C1=CCC1
InChIInChI=1S/C8H13NO/c1-6(2)9-8(10)7-4-3-5-7/h4,6H,3,5H2,1-2H3,(H,9,10)
InChIKeyUNVOAZPYCBSWFG-UHFFFAOYSA-N
XLogP1.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

methyl (2S)-2-(cyclobutene-1-carbonylamino)propanoate
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N-[(2S)-2-(cyclopentene-1-carbonylamino)-3-methylbutyl]cyclopentene-1-carboxamide
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N-propan-2-yl-6,7-dihydro-1H-indazole-4-carboxamide
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CID 102343479
2-fluoro-N-propan-2-ylcyclohexa-1,5-diene-1-carboxamide
CID 167447240
N-pent-1-yn-3-ylcyclopentene-1-carboxamide
CID 130920530
N-(2-hydroxyethyl)cyclobutene-1-carboxamide
CID 24802880
N-propan-2-yl-1H-indene-2-carboxamide
CID 141124355
4,5-dimethyl-N-propan-2-ylfuran-2-carboxamide;ethane
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cyclobutene-1-carbothioic S-acid
CID 87248869

Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylcyclobutene-1-carboxamide?
The IUPAC name of N-propan-2-ylcyclobutene-1-carboxamide (CID 126994401) is N-propan-2-ylcyclobutene-1-carboxamide.
What is the SMILES notation for N-propan-2-ylcyclobutene-1-carboxamide?
The canonical SMILES for N-propan-2-ylcyclobutene-1-carboxamide is CC(C)NC(=O)C1=CCC1.
What is the InChIKey of N-propan-2-ylcyclobutene-1-carboxamide?
The InChIKey is UNVOAZPYCBSWFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-6(2)9-8(10)7-4-3-5-7/h4,6H,3,5H2,1-2H3,(H,9,10).
What are the key properties of N-propan-2-ylcyclobutene-1-carboxamide?
N-propan-2-ylcyclobutene-1-carboxamide has a molecular weight of 139.20 g/mol, XLogP of 1.23, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-ylcyclobutene-1-carboxamide is sourced from PubChem (CID 126994401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).