N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide

C14H18N2O3 — CID 67712660

IUPACN-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide
SMILESO=C(Nc1cccc(/C=C/CO)c1)N1CCOCC1
InChIInChI=1S/C14H18N2O3/c17-8-2-4-12-3-1-5-13(11-12)15-14(18)16-6-9-19-10-7-16/h1-5,11,17H,6-10H2,(H,15,18)/b4-2+
InChIKeyGGMBGYPLLWESJT-DUXPYHPUSA-N
MW262.31 g/mol
LogP1.56
Rot. Bonds3

About N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide

N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide (PubChem CID 67712660) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide
PubChem CID67712660
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC NameN-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide
SMILESO=C(Nc1cccc(/C=C/CO)c1)N1CCOCC1
InChIInChI=1S/C14H18N2O3/c17-8-2-4-12-3-1-5-13(11-12)15-14(18)16-6-9-19-10-7-16/h1-5,11,17H,6-10H2,(H,15,18)/b4-2+
InChIKeyGGMBGYPLLWESJT-DUXPYHPUSA-N
XLogP1.56
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[3-(morpholine-4-carbonylamino)phenyl]prop-2-enoic acid
CID 115277723
N-[3-(morpholine-4-carbonylamino)phenyl]morpholine-4-carboxamide
CID 171576986
N-(3-acetamidophenyl)morpholine-4-carboxamide
CID 3707113
N-(3-formamidophenyl)morpholine-4-carboxamide
CID 168652828
N-[3-(methoxymethyl)phenyl]morpholine-4-carboxamide
CID 34684605
2-[3-(morpholine-4-carbonylamino)phenoxy]acetic acid
CID 61187144
(E)-3-[3-(piperazine-1-carbonylamino)phenyl]prop-2-enoic acid
CID 115340753
4-chloro-N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]benzamide
CID 67712313
N-(3-chlorophenyl)-3-morpholin-4-yl-3-oxopropanamide
CID 108943524
(E)-3-[3-[(4-hydroxypiperidine-1-carbonyl)amino]phenyl]prop-2-enoic acid
CID 115340576
N-[3-(pyrazol-1-ylmethyl)phenyl]morpholine-4-carboxamide
CID 34688755
N-(3,5-dihydroxyphenyl)morpholine-4-carboxamide
CID 108895379

Frequently Asked Questions

What is the IUPAC name of N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide?
The IUPAC name of N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide (CID 67712660) is N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide?
The canonical SMILES for N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide is O=C(Nc1cccc(/C=C/CO)c1)N1CCOCC1.
What is the InChIKey of N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide?
The InChIKey is GGMBGYPLLWESJT-DUXPYHPUSA-N. The full InChI is InChI=1S/C14H18N2O3/c17-8-2-4-12-3-1-5-13(11-12)15-14(18)16-6-9-19-10-7-16/h1-5,11,17H,6-10H2,(H,15,18)/b4-2+.
What are the key properties of N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide?
N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 67712660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).