N-(cyclopenten-1-yl)but-2-ynamide

C9H11NO — CID 140985868

IUPACN-(cyclopenten-1-yl)but-2-ynamide
SMILESCC#CC(=O)NC1=CCCC1
InChIInChI=1S/C9H11NO/c1-2-5-9(11)10-8-6-3-4-7-8/h6H,3-4,7H2,1H3,(H,10,11)
InChIKeyYHGBDLTVMCPGCD-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.19
Rot. Bonds1

About N-(cyclopenten-1-yl)but-2-ynamide

N-(cyclopenten-1-yl)but-2-ynamide (PubChem CID 140985868) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is N-(cyclopenten-1-yl)but-2-ynamide.

Molecular Properties

Compound NameN-(cyclopenten-1-yl)but-2-ynamide
PubChem CID140985868
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC NameN-(cyclopenten-1-yl)but-2-ynamide
SMILESCC#CC(=O)NC1=CCCC1
InChIInChI=1S/C9H11NO/c1-2-5-9(11)10-8-6-3-4-7-8/h6H,3-4,7H2,1H3,(H,10,11)
InChIKeyYHGBDLTVMCPGCD-UHFFFAOYSA-N
XLogP1.19
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(cyclopenten-1-yl)but-2-ynamide 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-(cyclopenten-1-yl)prop-2-enamide
CID 130013506
cycloocten-1-ylurea
CID 154107907
2-chloro-N-(cyclohexen-1-yl)acetamide
CID 22251791
N-[2-(2-methylpropyl)phenyl]but-2-ynamide
CID 138539040
N-propan-2-ylcyclopenten-1-amine
CID 57447311
N-trimethylsilyloxycyclopenten-1-amine
CID 91482678
N'-(cyclopenten-1-yl)-3,4-dimethylbenzohydrazide
CID 4744638
N-(2-aminophenyl)but-2-ynamide
CID 90330903
methyl N-[1-(cyclohexen-1-ylamino)-3-methyl-1-oxobutan-2-yl]carbamate
CID 135002029
N-(cyclopenten-1-yl)ethanesulfonamide
CID 57087407
N-(3-chloropyrazin-2-yl)but-2-ynamide
CID 107996159
N-but-2-ynoxycyclohexen-1-amine
CID 91804644

Frequently Asked Questions

What is the IUPAC name of N-(cyclopenten-1-yl)but-2-ynamide?
The IUPAC name of N-(cyclopenten-1-yl)but-2-ynamide (CID 140985868) is N-(cyclopenten-1-yl)but-2-ynamide.
What is the SMILES notation for N-(cyclopenten-1-yl)but-2-ynamide?
The canonical SMILES for N-(cyclopenten-1-yl)but-2-ynamide is CC#CC(=O)NC1=CCCC1.
What is the InChIKey of N-(cyclopenten-1-yl)but-2-ynamide?
The InChIKey is YHGBDLTVMCPGCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-2-5-9(11)10-8-6-3-4-7-8/h6H,3-4,7H2,1H3,(H,10,11).
What are the key properties of N-(cyclopenten-1-yl)but-2-ynamide?
N-(cyclopenten-1-yl)but-2-ynamide has a molecular weight of 149.19 g/mol, XLogP of 1.19, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopenten-1-yl)but-2-ynamide is sourced from PubChem (CID 140985868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).