N-(3-formamidophenyl)morpholine-4-carboxamide

C12H15N3O3 — CID 168652828

IUPACN-(3-formamidophenyl)morpholine-4-carboxamide
SMILESO=CNc1cccc(NC(=O)N2CCOCC2)c1
InChIInChI=1S/C12H15N3O3/c16-9-13-10-2-1-3-11(8-10)14-12(17)15-4-6-18-7-5-15/h1-3,8-9H,4-7H2,(H,13,16)(H,14,17)
InChIKeyJOGVGSBJJFFXKF-UHFFFAOYSA-N
MW249.27 g/mol
LogP1.12
Rot. Bonds3

About N-(3-formamidophenyl)morpholine-4-carboxamide

N-(3-formamidophenyl)morpholine-4-carboxamide (PubChem CID 168652828) has the molecular formula C12H15N3O3 and a molecular weight of 249.27 g/mol. Its IUPAC name is N-(3-formamidophenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(3-formamidophenyl)morpholine-4-carboxamide
PubChem CID168652828
Molecular FormulaC12H15N3O3
Molecular Weight249.27 g/mol
Exact Mass249.11
IUPAC NameN-(3-formamidophenyl)morpholine-4-carboxamide
SMILESO=CNc1cccc(NC(=O)N2CCOCC2)c1
InChIInChI=1S/C12H15N3O3/c16-9-13-10-2-1-3-11(8-10)14-12(17)15-4-6-18-7-5-15/h1-3,8-9H,4-7H2,(H,13,16)(H,14,17)
InChIKeyJOGVGSBJJFFXKF-UHFFFAOYSA-N
XLogP1.12
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(morpholine-4-carbonylamino)phenyl]morpholine-4-carboxamide
CID 171576986
N-(3-acetamidophenyl)morpholine-4-carboxamide
CID 3707113
3-[3-(morpholine-4-carbonylamino)phenyl]prop-2-enoic acid
CID 115277723
N-[3-[(E)-3-hydroxyprop-1-enyl]phenyl]morpholine-4-carboxamide
CID 67712660
N-[3-(methoxymethyl)phenyl]morpholine-4-carboxamide
CID 34684605
2-[3-(morpholine-4-carbonylamino)phenoxy]acetic acid
CID 61187144
N-(3,5-dihydroxyphenyl)morpholine-4-carboxamide
CID 108895379
N-(3-tert-butylphenyl)-4-(morpholine-4-carbonyl)-1,4-diazepane-1-carboxamide
CID 59143361
N-[3-(pyrazol-1-ylmethyl)phenyl]morpholine-4-carboxamide
CID 34688755
N-(4-cyanophenyl)morpholine-4-carboxamide
CID 4984315
N-(4-chloro-3-fluorophenyl)morpholine-4-carboxamide
CID 47223545
N-(3-formamidophenyl)cyclopropanecarboxamide
CID 64991224

Frequently Asked Questions

What is the IUPAC name of N-(3-formamidophenyl)morpholine-4-carboxamide?
The IUPAC name of N-(3-formamidophenyl)morpholine-4-carboxamide (CID 168652828) is N-(3-formamidophenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(3-formamidophenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(3-formamidophenyl)morpholine-4-carboxamide is O=CNc1cccc(NC(=O)N2CCOCC2)c1.
What is the InChIKey of N-(3-formamidophenyl)morpholine-4-carboxamide?
The InChIKey is JOGVGSBJJFFXKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3/c16-9-13-10-2-1-3-11(8-10)14-12(17)15-4-6-18-7-5-15/h1-3,8-9H,4-7H2,(H,13,16)(H,14,17).
What are the key properties of N-(3-formamidophenyl)morpholine-4-carboxamide?
N-(3-formamidophenyl)morpholine-4-carboxamide has a molecular weight of 249.27 g/mol, XLogP of 1.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-formamidophenyl)morpholine-4-carboxamide is sourced from PubChem (CID 168652828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).