N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide

C14H23NO2 — CID 102866471

IUPACN-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide
SMILESO=C(CC1C=CCC1)N(CCCO)C1CCC1
InChIInChI=1S/C14H23NO2/c16-10-4-9-15(13-7-3-8-13)14(17)11-12-5-1-2-6-12/h1,5,12-13,16H,2-4,6-11H2
InChIKeyBVMFVHCWNAFBNB-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.11
Rot. Bonds6

About N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide

N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide (PubChem CID 102866471) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide.

Molecular Properties

Compound NameN-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide
PubChem CID102866471
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide
SMILESO=C(CC1C=CCC1)N(CCCO)C1CCC1
InChIInChI=1S/C14H23NO2/c16-10-4-9-15(13-7-3-8-13)14(17)11-12-5-1-2-6-12/h1,5,12-13,16H,2-4,6-11H2
InChIKeyBVMFVHCWNAFBNB-UHFFFAOYSA-N
XLogP2.11
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)-N-propan-2-ylacetamide
CID 61040291
2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(2-methylpropyl)acetamide
CID 78850541
2-[(1S)-cyclopent-2-en-1-yl]-N-[(3R)-1,1-dioxothiolan-3-yl]-N-propylacetamide
CID 52556128
2-(2-bicyclo[2.2.1]heptanyl)-N-cyclobutyl-N-(3-hydroxypropyl)acetamide
CID 102866283
2-cyclopent-2-en-1-yl-N-ethyl-N-piperidin-4-ylacetamide
CID 54923345
4-amino-N-cyclobutyl-N-(3-hydroxypropyl)cyclopent-2-ene-1-carboxamide
CID 102861672
N-cyclobutyl-N-(3-hydroxypropyl)-2-methoxyacetamide
CID 102866415
N-cyclobutyl-2-(1,1-dioxothiolan-3-yl)-N-(3-hydroxypropyl)acetamide
CID 102867055
5-amino-N-cyclobutyl-N-(3-hydroxypropyl)pentanamide
CID 102861717
N-cyclobutyl-N-(3-hydroxypropyl)-2-methylsulfonylacetamide
CID 102866191
2-cyclopent-2-en-1-yl-N-cyclopropyl-N-(furan-2-ylmethyl)acetamide
CID 47022974
2-cyclopent-2-en-1-yl-N-methyl-N-(3,3,3-trifluoropropyl)acetamide
CID 86833481

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide?
The IUPAC name of N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide (CID 102866471) is N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide.
What is the SMILES notation for N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide?
The canonical SMILES for N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide is O=C(CC1C=CCC1)N(CCCO)C1CCC1.
What is the InChIKey of N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide?
The InChIKey is BVMFVHCWNAFBNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c16-10-4-9-15(13-7-3-8-13)14(17)11-12-5-1-2-6-12/h1,5,12-13,16H,2-4,6-11H2.
What are the key properties of N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide?
N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide has a molecular weight of 237.34 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-2-cyclopent-2-en-1-yl-N-(3-hydroxypropyl)acetamide is sourced from PubChem (CID 102866471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).