N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide

C13H17ClN2O2 — CID 66259041

IUPACN-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C13H17ClN2O2/c1-2-15-12-8-18-7-9(12)13(17)16-11-6-4-3-5-10(11)14/h3-6,9,12,15H,2,7-8H2,1H3,(H,16,17)
InChIKeyVMMXJJUZIZIXJO-UHFFFAOYSA-N
MW268.74 g/mol
LogP1.90
Rot. Bonds4

About N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide

N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide (PubChem CID 66259041) has the molecular formula C13H17ClN2O2 and a molecular weight of 268.74 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide
PubChem CID66259041
Molecular FormulaC13H17ClN2O2
Molecular Weight268.74 g/mol
Exact Mass268.10
IUPAC NameN-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide
SMILESCCNC1COCC1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C13H17ClN2O2/c1-2-15-12-8-18-7-9(12)13(17)16-11-6-4-3-5-10(11)14/h3-6,9,12,15H,2,7-8H2,1H3,(H,16,17)
InChIKeyVMMXJJUZIZIXJO-UHFFFAOYSA-N
XLogP1.90
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.74
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloro-6-methylphenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66254364
N-(3-bromo-2-methylphenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 107625139
N-[2-(difluoromethoxy)phenyl]-4-(ethylamino)oxolane-3-carboxamide
CID 66257880
N-[1-(2-chlorophenyl)propan-2-yl]-4-(ethylamino)oxolane-3-carboxamide
CID 66257504
N-(2,4-difluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66259805
N-(2-bromo-5-methylphenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 82756801
N-(2-chloro-4-iodophenyl)-4-(propylamino)oxolane-3-carboxamide
CID 66254611
4-(ethylamino)-N-(2-propan-2-yloxy-3-pyridinyl)oxolane-3-carboxamide
CID 66258519
N-(3-chloro-2-fluorophenyl)-4-(methylamino)oxolane-3-carboxamide
CID 66266165
N-(2-bromo-5-fluorophenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 107625654
N-(2,4-dimethoxyphenyl)-4-(ethylamino)oxolane-3-carboxamide
CID 66259800
4-(ethylamino)-N-(4-propylphenyl)oxolane-3-carboxamide
CID 66260204

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide (CID 66259041) is N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide is CCNC1COCC1C(=O)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide?
The InChIKey is VMMXJJUZIZIXJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O2/c1-2-15-12-8-18-7-9(12)13(17)16-11-6-4-3-5-10(11)14/h3-6,9,12,15H,2,7-8H2,1H3,(H,16,17).
What are the key properties of N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide?
N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide has a molecular weight of 268.74 g/mol, XLogP of 1.90, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-(ethylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66259041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).