N-cyclohex-2-en-1-ylpropanamide

C9H15NO — CID 13421053

IUPACN-cyclohex-2-en-1-ylpropanamide
SMILESCCC(=O)NC1C=CCCC1
InChIInChI=1S/C9H15NO/c1-2-9(11)10-8-6-4-3-5-7-8/h4,6,8H,2-3,5,7H2,1H3,(H,10,11)
InChIKeyQOJWBJXNSFYHBJ-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.62
Rot. Bonds2

About N-cyclohex-2-en-1-ylpropanamide

N-cyclohex-2-en-1-ylpropanamide (PubChem CID 13421053) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-cyclohex-2-en-1-ylpropanamide.

Molecular Properties

Compound NameN-cyclohex-2-en-1-ylpropanamide
PubChem CID13421053
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-cyclohex-2-en-1-ylpropanamide
SMILESCCC(=O)NC1C=CCCC1
InChIInChI=1S/C9H15NO/c1-2-9(11)10-8-6-4-3-5-7-8/h4,6,8H,2-3,5,7H2,1H3,(H,10,11)
InChIKeyQOJWBJXNSFYHBJ-UHFFFAOYSA-N
XLogP1.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohex-2-en-1-ylpropanamide?
The IUPAC name of N-cyclohex-2-en-1-ylpropanamide (CID 13421053) is N-cyclohex-2-en-1-ylpropanamide.
What is the SMILES notation for N-cyclohex-2-en-1-ylpropanamide?
The canonical SMILES for N-cyclohex-2-en-1-ylpropanamide is CCC(=O)NC1C=CCCC1.
What is the InChIKey of N-cyclohex-2-en-1-ylpropanamide?
The InChIKey is QOJWBJXNSFYHBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-2-9(11)10-8-6-4-3-5-7-8/h4,6,8H,2-3,5,7H2,1H3,(H,10,11).
What are the key properties of N-cyclohex-2-en-1-ylpropanamide?
N-cyclohex-2-en-1-ylpropanamide has a molecular weight of 153.22 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-ylpropanamide is sourced from PubChem (CID 13421053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).