N-(4-anilinophenyl)oxolane-2-carboxamide

C17H18N2O2 — CID 4690010

IUPACN-(4-anilinophenyl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(Nc2ccccc2)cc1)C1CCCO1
InChIInChI=1S/C17H18N2O2/c20-17(16-7-4-12-21-16)19-15-10-8-14(9-11-15)18-13-5-2-1-3-6-13/h1-3,5-6,8-11,16,18H,4,7,12H2,(H,19,20)
InChIKeyYNZMOLYFIVMUIT-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.55
Rot. Bonds4

About N-(4-anilinophenyl)oxolane-2-carboxamide

N-(4-anilinophenyl)oxolane-2-carboxamide (PubChem CID 4690010) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-(4-anilinophenyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(4-anilinophenyl)oxolane-2-carboxamide
PubChem CID4690010
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-(4-anilinophenyl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(Nc2ccccc2)cc1)C1CCCO1
InChIInChI=1S/C17H18N2O2/c20-17(16-7-4-12-21-16)19-15-10-8-14(9-11-15)18-13-5-2-1-3-6-13/h1-3,5-6,8-11,16,18H,4,7,12H2,(H,19,20)
InChIKeyYNZMOLYFIVMUIT-UHFFFAOYSA-N
XLogP3.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-phenyloxolane-2-carboxamide
CID 3453643
N-(4-benzoylphenyl)oxolane-2-carboxamide
CID 11839657
N-[4-(3,5-dimethylanilino)phenyl]oxolane-2-carboxamide
CID 112986386
(2S)-N-[3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 7027817
N-[4-(3,4-dimethylanilino)phenyl]oxolane-2-carboxamide
CID 112986357
N-[4-(2-cyanoanilino)phenyl]oxolane-2-carboxamide
CID 112989824
1-[4-[[(2R)-oxolane-2-carbonyl]amino]phenyl]cyclopropane-1-carboxylic acid
CID 104855967
N-[4-[(2-amino-2-phenylacetyl)amino]phenyl]oxolane-2-carboxamide
CID 119282778
3-[[(2S)-oxolane-2-carbonyl]amino]benzoic acid
CID 839554
(2R)-N-[2-(phenylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 7347410
(2S)-N-(4-tert-butylphenyl)oxolane-2-carboxamide
CID 8779725
(2S)-N-[4-[(2-iodobenzoyl)amino]phenyl]oxolane-2-carboxamide
CID 37396701

Frequently Asked Questions

What is the IUPAC name of N-(4-anilinophenyl)oxolane-2-carboxamide?
The IUPAC name of N-(4-anilinophenyl)oxolane-2-carboxamide (CID 4690010) is N-(4-anilinophenyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(4-anilinophenyl)oxolane-2-carboxamide?
The canonical SMILES for N-(4-anilinophenyl)oxolane-2-carboxamide is O=C(Nc1ccc(Nc2ccccc2)cc1)C1CCCO1.
What is the InChIKey of N-(4-anilinophenyl)oxolane-2-carboxamide?
The InChIKey is YNZMOLYFIVMUIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c20-17(16-7-4-12-21-16)19-15-10-8-14(9-11-15)18-13-5-2-1-3-6-13/h1-3,5-6,8-11,16,18H,4,7,12H2,(H,19,20).
What are the key properties of N-(4-anilinophenyl)oxolane-2-carboxamide?
N-(4-anilinophenyl)oxolane-2-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 3.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-anilinophenyl)oxolane-2-carboxamide is sourced from PubChem (CID 4690010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).