(4-morpholin-2-yl-2-phenylphenyl) carbamate

C17H18N2O3 — CID 174693399

IUPAC(4-morpholin-2-yl-2-phenylphenyl) carbamate
SMILESNC(=O)Oc1ccc(C2CNCCO2)cc1-c1ccccc1
InChIInChI=1S/C17H18N2O3/c18-17(20)22-15-7-6-13(16-11-19-8-9-21-16)10-14(15)12-4-2-1-3-5-12/h1-7,10,16,19H,8-9,11H2,(H2,18,20)
InChIKeyKAAIKLNCYHEJLJ-UHFFFAOYSA-N
MW298.34 g/mol
LogP2.47
Rot. Bonds3

About (4-morpholin-2-yl-2-phenylphenyl) carbamate

(4-morpholin-2-yl-2-phenylphenyl) carbamate (PubChem CID 174693399) has the molecular formula C17H18N2O3 and a molecular weight of 298.34 g/mol. Its IUPAC name is (4-morpholin-2-yl-2-phenylphenyl) carbamate.

Molecular Properties

Compound Name(4-morpholin-2-yl-2-phenylphenyl) carbamate
PubChem CID174693399
Molecular FormulaC17H18N2O3
Molecular Weight298.34 g/mol
Exact Mass298.13
IUPAC Name(4-morpholin-2-yl-2-phenylphenyl) carbamate
SMILESNC(=O)Oc1ccc(C2CNCCO2)cc1-c1ccccc1
InChIInChI=1S/C17H18N2O3/c18-17(20)22-15-7-6-13(16-11-19-8-9-21-16)10-14(15)12-4-2-1-3-5-12/h1-7,10,16,19H,8-9,11H2,(H2,18,20)
InChIKeyKAAIKLNCYHEJLJ-UHFFFAOYSA-N
XLogP2.47
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2R)-morpholin-2-yl]benzoic acid
CID 169449190
4-[2-fluoro-4-[(2S)-morpholin-2-yl]phenyl]-1-methyl-3-phenylpyrazole-5-carboxylic acid
CID 71093668
azane;2-phenylmorpholine
CID 174664757
4-[(2R)-morpholin-2-yl]benzoic acid
CID 96582723
4-morpholin-2-yl-2-phenylmethoxyphenol
CID 117459594
1-methyl-1-(3-morpholin-2-ylphenyl)urea
CID 117342534
2,6-difluoro-4-morpholin-2-ylbenzoic acid
CID 117359158
N-hydroxy-2-(4-morpholin-2-ylphenyl)-2-phenylacetamide
CID 175263952
2-bromo-4-morpholin-2-ylphenol
CID 82623546
2-(4-phenylmethoxy-3-propylphenyl)morpholine
CID 69353396
2-[4-methoxy-3-(methoxymethyl)phenyl]morpholine
CID 117346859
2-[3-(3-methoxyphenyl)phenyl]morpholine
CID 82092915

Frequently Asked Questions

What is the IUPAC name of (4-morpholin-2-yl-2-phenylphenyl) carbamate?
The IUPAC name of (4-morpholin-2-yl-2-phenylphenyl) carbamate (CID 174693399) is (4-morpholin-2-yl-2-phenylphenyl) carbamate.
What is the SMILES notation for (4-morpholin-2-yl-2-phenylphenyl) carbamate?
The canonical SMILES for (4-morpholin-2-yl-2-phenylphenyl) carbamate is NC(=O)Oc1ccc(C2CNCCO2)cc1-c1ccccc1.
What is the InChIKey of (4-morpholin-2-yl-2-phenylphenyl) carbamate?
The InChIKey is KAAIKLNCYHEJLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O3/c18-17(20)22-15-7-6-13(16-11-19-8-9-21-16)10-14(15)12-4-2-1-3-5-12/h1-7,10,16,19H,8-9,11H2,(H2,18,20).
What are the key properties of (4-morpholin-2-yl-2-phenylphenyl) carbamate?
(4-morpholin-2-yl-2-phenylphenyl) carbamate has a molecular weight of 298.34 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-morpholin-2-yl-2-phenylphenyl) carbamate is sourced from PubChem (CID 174693399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).