N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide

C8H9NO2 — CID 126999358

IUPACN-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide
SMILESC#CCNC(=O)C1=CCCO1
InChIInChI=1S/C8H9NO2/c1-2-5-9-8(10)7-4-3-6-11-7/h1,4H,3,5-6H2,(H,9,10)
InChIKeyOOQJXEMGZDIXRY-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.04
Rot. Bonds2

About N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide

N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide (PubChem CID 126999358) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide.

Molecular Properties

Compound NameN-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide
PubChem CID126999358
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC NameN-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide
SMILESC#CCNC(=O)C1=CCCO1
InChIInChI=1S/C8H9NO2/c1-2-5-9-8(10)7-4-3-6-11-7/h1,4H,3,5-6H2,(H,9,10)
InChIKeyOOQJXEMGZDIXRY-UHFFFAOYSA-N
XLogP0.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-fluoroethyl)-2,3-dihydrofuran-5-carboxamide
CID 130723672
N-(2-oxobutyl)-2,3-dihydrofuran-5-carboxamide
CID 89020241
N-methyl-2,3-dihydrofuran-5-carboxamide
CID 89344938
N-ethyl-2-methyl-2,3-dihydrofuran-5-carboxamide
CID 164015740
N-[2-(methylamino)ethyl]-2,3-dihydrofuran-5-carboxamide
CID 164089218
Methyl 2-(2,3-dihydrofuran-5-carbonylamino)acetate
CID 170040965
5-methoxy-N-(2-methoxyethyl)-4-oxo-4H-pyran-2-carboxamide
CID 99998918
5-but-3-enoxy-2,3-dihydro-1H-pyridin-6-one
CID 101503646
N-but-2-ynyl-2,3-dihydrofuran-5-carboxamide
CID 130622044
N-pent-1-yn-3-yl-2,3-dihydrofuran-5-carboxamide
CID 130627716
N-(2-chloroprop-2-enyl)-2,3-dihydrofuran-5-carboxamide
CID 130662793
N-ethyl-2,3-dihydrofuran-5-carboxamide
CID 130668490

Frequently Asked Questions

What is the IUPAC name of N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide?
The IUPAC name of N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide (CID 126999358) is N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide.
What is the SMILES notation for N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide?
The canonical SMILES for N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide is C#CCNC(=O)C1=CCCO1.
What is the InChIKey of N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide?
The InChIKey is OOQJXEMGZDIXRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c1-2-5-9-8(10)7-4-3-6-11-7/h1,4H,3,5-6H2,(H,9,10).
What are the key properties of N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide?
N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide has a molecular weight of 151.16 g/mol, XLogP of 0.04, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-ynyl-2,3-dihydrofuran-5-carboxamide is sourced from PubChem (CID 126999358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).