(E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide

C15H19NO3 — CID 55063743

IUPAC(E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide
SMILESO=C(/C=C/c1ccc(O)cc1)NC1CCCCC1O
InChIInChI=1S/C15H19NO3/c17-12-8-5-11(6-9-12)7-10-15(19)16-13-3-1-2-4-14(13)18/h5-10,13-14,17-18H,1-4H2,(H,16,19)/b10-7+
InChIKeyFKCFNDQKGOFSGK-JXMROGBWSA-N
MW261.32 g/mol
LogP1.83
Rot. Bonds3

About (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide

(E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide (PubChem CID 55063743) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide
PubChem CID55063743
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Name(E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide
SMILESO=C(/C=C/c1ccc(O)cc1)NC1CCCCC1O
InChIInChI=1S/C15H19NO3/c17-12-8-5-11(6-9-12)7-10-15(19)16-13-3-1-2-4-14(13)18/h5-10,13-14,17-18H,1-4H2,(H,16,19)/b10-7+
InChIKeyFKCFNDQKGOFSGK-JXMROGBWSA-N
XLogP1.83
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(E)-3-(4-hydroxyphenyl)-N-[(1S,2S)-2-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]cyclohexyl]prop-2-enamide
CID 102001285
(E)-3-(4-fluorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]prop-2-enamide
CID 104956851
(E)-N-(2-hydroxycyclohexyl)-3-phenylprop-2-enamide
CID 14965451
N-(2-hydroxycyclohexyl)-3-(4-methoxyphenyl)prop-2-enamide
CID 76941549
N-(2-hydroxycyclohexyl)-3-(4-nitrophenyl)prop-2-enamide
CID 76941521
(E)-3-phenyl-N-[(1S,2S)-2-[[(E)-3-phenylprop-2-enoyl]amino]cyclohexyl]prop-2-enamide
CID 1334632
3-(3-bromophenyl)-N-(2-hydroxycyclohexyl)prop-2-enamide
CID 76941453
(E)-N-[(1R,2R)-2-hydroxycyclohexyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide
CID 104927951
3-(4-methoxyphenyl)-N-[(2S)-2-[3-(4-methoxyphenyl)prop-2-enoylamino]cyclohexyl]prop-2-enamide
CID 123929068
(E)-3-(3-fluoro-4-methoxyphenyl)-N-[(1R,2R)-2-hydroxycyclohexyl]prop-2-enamide
CID 104927946
3-(furan-2-yl)-N-(2-hydroxycyclohexyl)prop-2-enamide
CID 76941530
N-(2-hydroxycyclohexyl)-3-thiophen-2-ylprop-2-enamide
CID 76941528

Frequently Asked Questions

What is the IUPAC name of (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide?
The IUPAC name of (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide (CID 55063743) is (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide.
What is the SMILES notation for (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide?
The canonical SMILES for (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide is O=C(/C=C/c1ccc(O)cc1)NC1CCCCC1O.
What is the InChIKey of (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide?
The InChIKey is FKCFNDQKGOFSGK-JXMROGBWSA-N. The full InChI is InChI=1S/C15H19NO3/c17-12-8-5-11(6-9-12)7-10-15(19)16-13-3-1-2-4-14(13)18/h5-10,13-14,17-18H,1-4H2,(H,16,19)/b10-7+.
What are the key properties of (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide?
(E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide has a molecular weight of 261.32 g/mol, XLogP of 1.83, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2-hydroxycyclohexyl)-3-(4-hydroxyphenyl)prop-2-enamide is sourced from PubChem (CID 55063743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).