(Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide

C14H25NO — CID 139950049

IUPAC(Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide
SMILESCCN(CC)C(=O)/C(C)=C\C1CCCCC1
InChIInChI=1S/C14H25NO/c1-4-15(5-2)14(16)12(3)11-13-9-7-6-8-10-13/h11,13H,4-10H2,1-3H3/b12-11-
InChIKeyNSAFKMFLXLWXGY-QXMHVHEDSA-N
MW223.36 g/mol
LogP3.38
Rot. Bonds4

About (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide

(Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide (PubChem CID 139950049) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide.

Molecular Properties

Compound Name(Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide
PubChem CID139950049
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name(Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide
SMILESCCN(CC)C(=O)/C(C)=C\C1CCCCC1
InChIInChI=1S/C14H25NO/c1-4-15(5-2)14(16)12(3)11-13-9-7-6-8-10-13/h11,13H,4-10H2,1-3H3/b12-11-
InChIKeyNSAFKMFLXLWXGY-QXMHVHEDSA-N
XLogP3.38
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.38
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 (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide?
The IUPAC name of (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide (CID 139950049) is (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide.
What is the SMILES notation for (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide?
The canonical SMILES for (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide is CCN(CC)C(=O)/C(C)=C\C1CCCCC1.
What is the InChIKey of (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide?
The InChIKey is NSAFKMFLXLWXGY-QXMHVHEDSA-N. The full InChI is InChI=1S/C14H25NO/c1-4-15(5-2)14(16)12(3)11-13-9-7-6-8-10-13/h11,13H,4-10H2,1-3H3/b12-11-.
What are the key properties of (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide?
(Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide has a molecular weight of 223.36 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-cyclohexyl-N,N-diethyl-2-methylprop-2-enamide is sourced from PubChem (CID 139950049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).