N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide

C13H16F2N2O2 — CID 66259805

IUPACN-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C13H16F2N2O2/c1-2-16-12-7-19-6-9(12)13(18)17-11-4-3-8(14)5-10(11)15/h3-5,9,12,16H,2,6-7H2,1H3,(H,17,18)
InChIKeyNKTYVNYUJRIWPK-UHFFFAOYSA-N
MW270.28 g/mol
LogP1.53
Rot. Bonds4

About N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide

N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide (PubChem CID 66259805) has the molecular formula C13H16F2N2O2 and a molecular weight of 270.28 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
PubChem CID66259805
Molecular FormulaC13H16F2N2O2
Molecular Weight270.28 g/mol
Exact Mass270.12
IUPAC NameN-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C13H16F2N2O2/c1-2-16-12-7-19-6-9(12)13(18)17-11-4-3-8(14)5-10(11)15/h3-5,9,12,16H,2,6-7H2,1H3,(H,17,18)
InChIKeyNKTYVNYUJRIWPK-UHFFFAOYSA-N
XLogP1.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromo-5-fluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 107625654
N-(2-ethoxy-4-fluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66259259
N-(5-bromo-2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 102853704
N-(2-bromo-4-fluorophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66254786
N-(2-cyano-4-fluorophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 82683106
N-(2,4-dimethoxyphenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66259800
3-bromo-4-[[4-(ethylamino)oxolane-3-carbonyl]amino]benzoic acid
CID 66260276
N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66259041
N-(2-bromo-5-methylphenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 82756801
N-[2-(difluoromethoxy)phenyl]-4-(ethylamino)oxolane-3-carboxamide
CID 66257880
1-N,2-N-bis(2,4-difluorophenyl)cyclopropane-1,2-dicarboxamide
CID 109144111
N-(4-fluorophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66255163

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide (CID 66259805) is N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide is CCNC1COCC1C(=O)Nc1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide?
The InChIKey is NKTYVNYUJRIWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O2/c1-2-16-12-7-19-6-9(12)13(18)17-11-4-3-8(14)5-10(11)15/h3-5,9,12,16H,2,6-7H2,1H3,(H,17,18).
What are the key properties of N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide?
N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide has a molecular weight of 270.28 g/mol, XLogP of 1.53, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66259805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).