N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride

C19H21ClFN3O3 — CID 119723841

IUPACN-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(Cc1ccccc1)Nc1cc(NC(=O)C2CNCCO2)ccc1F
InChIInChI=1S/C19H20FN3O3.ClH/c20-15-7-6-14(22-19(25)17-12-21-8-9-26-17)11-16(15)23-18(24)10-13-4-2-1-3-5-13;/h1-7,11,17,21H,8-10,12H2,(H,22,25)(H,23,24);1H
InChIKeyUQULBCQBDLFUKV-UHFFFAOYSA-N
MW393.85 g/mol
LogP2.36
Rot. Bonds5

About N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride

N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119723841) has the molecular formula C19H21ClFN3O3 and a molecular weight of 393.85 g/mol. Its IUPAC name is N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119723841
Molecular FormulaC19H21ClFN3O3
Molecular Weight393.85 g/mol
Exact Mass393.13
IUPAC NameN-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride
SMILESCl.O=C(Cc1ccccc1)Nc1cc(NC(=O)C2CNCCO2)ccc1F
InChIInChI=1S/C19H20FN3O3.ClH/c20-15-7-6-14(22-19(25)17-12-21-8-9-26-17)11-16(15)23-18(24)10-13-4-2-1-3-5-13;/h1-7,11,17,21H,8-10,12H2,(H,22,25)(H,23,24);1H
InChIKeyUQULBCQBDLFUKV-UHFFFAOYSA-N
XLogP2.36
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.85
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]piperidine-3-carboxamide;hydrochloride
CID 119289646
N-[4-(phenylmethoxymethyl)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119794532
N-[4-(phenylmethoxymethyl)phenyl]morpholine-2-carboxamide
CID 119794533
N-(3-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119675709
N-[2-fluoro-5-[[2-(4-fluorophenyl)acetyl]amino]phenyl]-2-phenylacetamide
CID 87006955
N-(2,4,5-trifluorophenyl)morpholine-2-carboxamide
CID 62816271
N-(4-ethoxy-3-fluorophenyl)morpholine-2-carboxamide;hydrochloride
CID 119742216
N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]-3-piperidin-3-ylbutanamide
CID 119723826
N-(2-ethylphenyl)morpholine-2-carboxamide;hydrochloride
CID 119679075
N-[3-(carbamoylamino)phenyl]morpholine-2-carboxamide;hydrochloride
CID 119702027
3-[4-(morpholine-2-carbonylamino)phenyl]propanoic acid
CID 115340051
N-[2-fluoro-5-(oxolan-3-ylamino)phenyl]-2-phenylacetamide
CID 75502768

Frequently Asked Questions

What is the IUPAC name of N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride (CID 119723841) is N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride is Cl.O=C(Cc1ccccc1)Nc1cc(NC(=O)C2CNCCO2)ccc1F.
What is the InChIKey of N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is UQULBCQBDLFUKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O3.ClH/c20-15-7-6-14(22-19(25)17-12-21-8-9-26-17)11-16(15)23-18(24)10-13-4-2-1-3-5-13;/h1-7,11,17,21H,8-10,12H2,(H,22,25)(H,23,24);1H.
What are the key properties of N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride?
N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 393.85 g/mol, XLogP of 2.36, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-fluoro-3-[(2-phenylacetyl)amino]phenyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119723841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).