N-(cyclohexen-1-yl)prop-2-enamide

C9H13NO — CID 11126448

IUPACN-(cyclohexen-1-yl)prop-2-enamide
SMILESC=CC(=O)NC1=CCCCC1
InChIInChI=1S/C9H13NO/c1-2-9(11)10-8-6-4-3-5-7-8/h2,6H,1,3-5,7H2,(H,10,11)
InChIKeyLKQYUEWRBJVWFH-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.75
Rot. Bonds2

About N-(cyclohexen-1-yl)prop-2-enamide

N-(cyclohexen-1-yl)prop-2-enamide (PubChem CID 11126448) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is N-(cyclohexen-1-yl)prop-2-enamide.

Molecular Properties

Compound NameN-(cyclohexen-1-yl)prop-2-enamide
PubChem CID11126448
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC NameN-(cyclohexen-1-yl)prop-2-enamide
SMILESC=CC(=O)NC1=CCCCC1
InChIInChI=1S/C9H13NO/c1-2-9(11)10-8-6-4-3-5-7-8/h2,6H,1,3-5,7H2,(H,10,11)
InChIKeyLKQYUEWRBJVWFH-UHFFFAOYSA-N
XLogP1.75
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexen-1-yl)prop-2-enamide?
The IUPAC name of N-(cyclohexen-1-yl)prop-2-enamide (CID 11126448) is N-(cyclohexen-1-yl)prop-2-enamide.
What is the SMILES notation for N-(cyclohexen-1-yl)prop-2-enamide?
The canonical SMILES for N-(cyclohexen-1-yl)prop-2-enamide is C=CC(=O)NC1=CCCCC1.
What is the InChIKey of N-(cyclohexen-1-yl)prop-2-enamide?
The InChIKey is LKQYUEWRBJVWFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-2-9(11)10-8-6-4-3-5-7-8/h2,6H,1,3-5,7H2,(H,10,11).
What are the key properties of N-(cyclohexen-1-yl)prop-2-enamide?
N-(cyclohexen-1-yl)prop-2-enamide has a molecular weight of 151.21 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexen-1-yl)prop-2-enamide is sourced from PubChem (CID 11126448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).