N-cyclohexyl-N-methylprop-2-enamide

C10H17NO — CID 10080759

IUPACN-cyclohexyl-N-methylprop-2-enamide
SMILESC=CC(=O)N(C)C1CCCCC1
InChIInChI=1S/C10H17NO/c1-3-10(12)11(2)9-7-5-4-6-8-9/h3,9H,1,4-8H2,2H3
InChIKeyLHLLNIZKYYRADT-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.96
Rot. Bonds2

About N-cyclohexyl-N-methylprop-2-enamide

N-cyclohexyl-N-methylprop-2-enamide (PubChem CID 10080759) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is N-cyclohexyl-N-methylprop-2-enamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methylprop-2-enamide
PubChem CID10080759
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC NameN-cyclohexyl-N-methylprop-2-enamide
SMILESC=CC(=O)N(C)C1CCCCC1
InChIInChI=1S/C10H17NO/c1-3-10(12)11(2)9-7-5-4-6-8-9/h3,9H,1,4-8H2,2H3
InChIKeyLHLLNIZKYYRADT-UHFFFAOYSA-N
XLogP1.96
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.96
H-Bond Donors ≤ 50
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-cyclohexyl-N-methylprop-2-enamide?
The IUPAC name of N-cyclohexyl-N-methylprop-2-enamide (CID 10080759) is N-cyclohexyl-N-methylprop-2-enamide.
What is the SMILES notation for N-cyclohexyl-N-methylprop-2-enamide?
The canonical SMILES for N-cyclohexyl-N-methylprop-2-enamide is C=CC(=O)N(C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methylprop-2-enamide?
The InChIKey is LHLLNIZKYYRADT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c1-3-10(12)11(2)9-7-5-4-6-8-9/h3,9H,1,4-8H2,2H3.
What are the key properties of N-cyclohexyl-N-methylprop-2-enamide?
N-cyclohexyl-N-methylprop-2-enamide has a molecular weight of 167.25 g/mol, XLogP of 1.96, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methylprop-2-enamide is sourced from PubChem (CID 10080759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).