N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide

C11H19NO2 — CID 23224348

IUPACN-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide
SMILESC=CC(=O)N(C(C)O)C1CCCCC1
InChIInChI=1S/C11H19NO2/c1-3-11(14)12(9(2)13)10-7-5-4-6-8-10/h3,9-10,13H,1,4-8H2,2H3
InChIKeyIXNJSAPJIGWLSF-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.67
Rot. Bonds3

About N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide

N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide (PubChem CID 23224348) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide.

Molecular Properties

Compound NameN-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide
PubChem CID23224348
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC NameN-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide
SMILESC=CC(=O)N(C(C)O)C1CCCCC1
InChIInChI=1S/C11H19NO2/c1-3-11(14)12(9(2)13)10-7-5-4-6-8-10/h3,9-10,13H,1,4-8H2,2H3
InChIKeyIXNJSAPJIGWLSF-UHFFFAOYSA-N
XLogP1.67
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

tert-butyl (2S)-2-[cyclohexyl(prop-2-enoyl)amino]propanoate
CID 70370984
N,N-bis(1-hydroxyethyl)prop-2-enamide
CID 22665003
1-[carbamoyl(cyclohexyl)amino]ethyl prop-2-enoate
CID 67747543
1-(dicyclohexylamino)ethyl prop-2-enoate
CID 142697109
N-cyclopropyl-N-[(2R)-2-hydroxypropyl]prop-2-enamide
CID 166415254
N-cyclopropyl-N-propan-2-ylcyclohexanecarboxamide
CID 110872848
N-(cyanomethyl)-N-cyclohexylprop-2-enamide
CID 102248410
N-butan-2-yl-N-cycloheptylacetamide
CID 102519619
(2S)-2-amino-N-cyclohexyl-N-[(2S)-1-oxopropan-2-yl]propanamide
CID 18658340
N-[2-(azepan-1-yl)ethyl]-N-cyclobutylprop-2-enamide
CID 126827314
N-cyclopropyl-N-propan-2-ylcyclopentanecarboxamide
CID 110872851
N,N'-dicyclohexyl-N,N'-di(propan-2-yl)dodecanediamide
CID 20752266

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide?
The IUPAC name of N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide (CID 23224348) is N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide.
What is the SMILES notation for N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide?
The canonical SMILES for N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide is C=CC(=O)N(C(C)O)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide?
The InChIKey is IXNJSAPJIGWLSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-3-11(14)12(9(2)13)10-7-5-4-6-8-10/h3,9-10,13H,1,4-8H2,2H3.
What are the key properties of N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide?
N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide has a molecular weight of 197.28 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(1-hydroxyethyl)prop-2-enamide is sourced from PubChem (CID 23224348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).